3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[2-(2,3-dimethoxyphenyl)-2-(1H-indol-3-yl)ethyl]propionamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(CNC(=O)CCSCC(=O)N)C2=CNC3=CC=CC=C32

Isomeric SMILES

COC1=CC=CC(=C1OC)C(CNC(=O)CCSCC(=O)N)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C23H27N3O4S/c1-29-20-9-5-7-16(23(20)30-2)18(13-26-22(28)10-11-31-14-21(24)27)17-12-25-19-8-4-3-6-15(17)19/h3-9,12,18,25H,10-11,13-14H2,1-2H3,(H2,24,27)(H,26,28)