ethyl 2-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]carbothioylamino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]carbothioylamino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-[[(2R)-2-methylindoline-1-carbothioyl]amino]thiophene-3-carboxylate CAS Name: 2-[[[(2R)-2-methyl-2,3-dihydroindol-1-yl]-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-[[(2R)-2-methyl-2,3-dihydroindole-1-carbothioyl]amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[[(2R)-2-methylindoline-1-carbothioyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H24N2O2S2 MolecularWeight: 436.58956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)N3C(CC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)N3[C@@H](CC4=CC=CC=C43)C

InChI

InChI=1S/C24H24N2O2S2/c1-3-28-23(27)20-15-19(14-17-9-5-4-6-10-17)30-22(20)25-24(29)26-16(2)13-18-11-7-8-12-21(18)26/h4-12,15-16H,3,13-14H2,1-2H3,(H,25,29)/t16-/m1/s1