ethyl 2-[[2-(1H-indol-3-yl)ethyl-(naphthalen-1-ylmethyl)carbamoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: ethyl 2-[[2-(1H-indol-3-yl)ethyl-(naphthalen-1-ylmethyl)carbamoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: ethyl 2-[[2-(1H-indol-3-yl)ethyl-(1-naphthylmethyl)carbamoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[2-(1H-indol-3-yl)ethyl-(1-naphthalenylmethyl)amino]-oxomethyl]amino]-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1H-indol-3-yl)ethyl-(naphthalen-1-ylmethyl)carbamoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(1H-indol-3-yl)ethyl-(1-naphthylmethyl)carbamoyl]amino]-4-(methylthio)butyric acid ethyl ester Formula: C29H33N3O3S MolecularWeight: 503.65562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C(CCSC)NC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H33N3O3S/c1-3-35-28(33)27(16-18-36-2)31-29(34)32(17-15-22-19-30-26-14-7-6-13-25(22)26)20-23-11-8-10-21-9-4-5-12-24(21)23/h4-14,19,27,30H,3,15-18,20H2,1-2H3,(H,31,34)