2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzamide

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzamide Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzamide CAS Name: 2-[(2-amino-2-oxoethyl)thio]-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzamide IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzamide Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2SCC(=O)N)C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2SCC(=O)N)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C26H25N3O3S/c1-32-18-12-10-17(11-13-18)21(22-15-28-23-8-4-2-6-19(22)23)14-29-26(31)20-7-3-5-9-24(20)33-16-25(27)30/h2-13,15,21,28H,14,16H2,1H3,(H2,27,30)(H,29,31)