Vitas-M small molecule compound
N-({2-[(3,5-dimethylphenyl)carbamoyl]phenyl}carbamothioyl)-1-methyl-1H-pyrazole-3-carboxamide
Catalog ID
STL386522
SMILES S=C(NC(=O)c1ccn(n1)C)Nc1ccccc1C(=O)Nc1cc(C)cc(c1)C
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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-13-10-14(2)12-15(11-13)22-19(27)16-6-4-5-7-17(16)23-21(29)24-20(28)18-8-9-26(3)25-18/h4-12H,1-3H3,(H,22,27)(H2,23,24,28,29)InChIKey
AVHVUIKONYTJFR-UHFFFAOYSA-NSynonyms
944777-19-9944777199
CC1=CC(=CC(=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=NN(C=C3)C)C
InChI=1SC21H21N5O2Sc1131014(2)1215(1113)2219(27)16645717(16)2321(29)2420(28)188926(3)2518h412H13H3(H2227)(H223242829)
MFCD04058158
N((2((35dimethylphenyl)carbamoyl)phenyl)carbamothioyl)1methyl1Hpyrazole3carboxamide
N((2((35dimethylphenyl)carbamoyl)phenyl)carbamothioyl)1methylpyrazole3carboxamide
ZINC000002806842
ZINC02806842
ZINC2806842
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