(2S)-2-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanoylamino]-N-naphthalen-2-yl-4-(3-oxidanylidenebutylsulfanyl)butanamide

Systemtic Name: (2S)-2-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanoylamino]-N-naphthalen-2-yl-4-(3-oxidanylidenebutylsulfanyl)butanamide Openeye Name: (2S)-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]-N-(2-naphthyl)-4-(3-oxobutylsulfanyl)butanamide CAS Name: (2S)-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)-1-oxoethyl]amino]-N-(2-naphthalenyl)-4-(3-oxobutylthio)butanamide IUPAC Name: (2S)-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]-N-naphthalen-2-yl-4-(3-oxobutylsulfanyl)butanamide Traditional Name: (2S)-4-(3-ketobutylthio)-2-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]-N-(2-naphthyl)butyramide Formula: C30H33N3O4S MolecularWeight: 531.66572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)NC(CCSCCC(=O)C)C(=O)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)N[C@@H](CCSCCC(=O)C)C(=O)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H33N3O4S/c1-19(34)12-14-38-15-13-28(30(36)32-23-9-8-21-6-4-5-7-22(21)16-23)33-29(35)18-25-20(2)31-27-11-10-24(37-3)17-26(25)27/h4-11,16-17,28,31H,12-15,18H2,1-3H3,(H,32,36)(H,33,35)/t28-/m0/s1