Vitas-M small molecule compound
5-phenyl-8-[(2-phenylethyl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STL226974
SMILES c1ccc(cc1)CCSc1ncnc2c1sc1c2c2CCCCc2c(n1)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 C27H23N3S2 MW 453.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3S2/c1-3-9-18(10-4-1)15-16-31-27-25-24(28-17-29-27)22-20-13-7-8-14-21(20)23(30-26(22)32-25)19-11-5-2-6-12-19/h1-6,9-12,17H,7-8,13-16H2InChIKey
URHHMLGBFMEYOI-UHFFFAOYSA-NSynonyms
552286-36-9552286369
5phenyl8((2phenylethyl)sulfanyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8(phenethylthio)5phenyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)SCCC5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC27H23N3S2c13918(1041)151631272524(28172927)222013781421(20)23(3026(22)3225)19115261219h1691217H781316H2
MFCD02993374
ZINC000009282729
ZINC09282729
ZINC9282729
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