N-[5-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]amino]-oxomethyl]-2-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-[[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]carbamoyl]-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-[[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide Formula: C23H21ClN4O2S2 MolecularWeight: 485.02144

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H21ClN4O2S2/c1-31-12-10-18(21-25-16-5-2-3-6-17(16)26-21)27-22(29)14-8-9-15(24)19(13-14)28-23(30)20-7-4-11-32-20/h2-9,11,13,18H,10,12H2,1H3,(H,25,26)(H,27,29)(H,28,30)/t18-/m0/s1