N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[2-(thiophen-3-ylmethylsulfanyl)ethylamino]propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[2-(thiophen-3-ylmethylsulfanyl)ethylamino]propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-[2-(3-thienylmethylsulfanyl)ethylamino]ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[2-(3-thiophenylmethylthio)ethylamino]propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[2-(thiophen-3-ylmethylsulfanyl)ethylamino]propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-[2-(3-thenylthio)ethylamino]ethyl]thiophene-2-carboxamide Formula: C23H23N3O2S3 MolecularWeight: 469.64262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NCCSCC3=CSC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NCCSCC3=CSC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H23N3O2S3/c27-22(24-8-11-30-15-16-7-10-29-14-16)20(26-23(28)21-6-3-9-31-21)12-17-13-25-19-5-2-1-4-18(17)19/h1-7,9-10,13-14,20,25H,8,11-12,15H2,(H,24,27)(H,26,28)/t20-/m0/s1