(6S)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-2-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-2-[[2-(1H-benzimidazol-2-ylthio)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H20N4O2S2/c1-10-6-7-11-14(8-10)27-18(16(11)17(20)25)23-15(24)9-26-19-21-12-4-2-3-5-13(12)22-19/h2-5,10H,6-9H2,1H3,(H2,20,25)(H,21,22)(H,23,24)/t10-/m0/s1