Vitas-M small molecule compound

N-(3-methoxyphenyl)-6-oxo-1-phenyl-3-[(phenylcarbonyl)amino]-2-thioxohexahydropyrimidine-4-carboxamide

Catalog ID
STK209905
SMILES COc1cccc(c1)NC(=O)C1CC(=O)N(C(=S)N1NC(=O)c1ccccc1)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H22N4O4S MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O4S/c1-33-20-14-8-11-18(15-20)26-24(32)21-16-22(30)28(19-12-6-3-7-13-19)25(34)29(21)27-23(31)17-9-4-2-5-10-17/h2-15,21H,16H2,1H3,(H,26,32)(H,27,31)
InChIKey
ARJQUEFVVKMABX-UHFFFAOYSA-N
Synonyms
956501-89-6
3BENZAMIDON(3METHOXYPHENYL)6OXO1PHENYL2SULFANYLIDENE13DIAZINANE4CARBOXAMIDE
3benzamidoN(3methoxyphenyl)6oxo1phenyl2thioxohexahydropyrimidine4carboxamide
3BENZOYLAMINO6OXO1PHENYL2THIOXOHEXAHYDROPYRIMIDINE4CARBOXYLICACID(3METHOXYPHENYL)AMIDE
956501896
COC1=CC=CC(=C1)NC(=O)C2CC(=O)N(C(=S)N2NC(=O)C3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC25H22N4O4Sc133201481118(1520)2624(32)211622(30)28(19126371319)25(34)29(21)2723(31)1794251017h21521H16H21H3(H2632)(H2731)
MFCD04163917
N(3METHOXYPHENYL)6OXO1PHENYL3((PHENYLCARBONYL)AMINO)2THIOXOHEXAHYDROPYRIMIDINE4CARBOXAMIDE
ZINC000008684761
ZINC000008684762

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.