N-(2-methyl-4-phenylazanyl-phenyl)-3-[3-[3-[(2-methyl-4-phenylazanyl-phenyl)amino]-3-oxidanylidene-propyl]sulfanylpropylsulfanyl]propanamide

Systemtic Name: N-(2-methyl-4-phenylazanyl-phenyl)-3-[3-[3-[(2-methyl-4-phenylazanyl-phenyl)amino]-3-oxidanylidene-propyl]sulfanylpropylsulfanyl]propanamide Openeye Name: 3-[3-[3-(4-anilino-2-methyl-anilino)-3-oxo-propyl]sulfanylpropylsulfanyl]-N-(4-anilino-2-methyl-phenyl)propanamide CAS Name: 3-[3-[[3-(4-anilino-2-methylanilino)-3-oxopropyl]thio]propylthio]-N-(4-anilino-2-methylphenyl)propanamide IUPAC Name: 3-[3-[3-(4-anilino-2-methylanilino)-3-oxopropyl]sulfanylpropylsulfanyl]-N-(4-anilino-2-methylphenyl)propanamide Traditional Name: 3-[3-[[3-(4-anilino-2-methyl-anilino)-3-keto-propyl]thio]propylthio]-N-(4-anilino-2-methyl-phenyl)propionamide Formula: C35H40N4O2S2 MolecularWeight: 612.8477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=CC=CC=C2)NC(=O)CCSCCCSCCC(=O)NC3=C(C=C(C=C3)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=CC=CC=C2)NC(=O)CCSCCCSCCC(=O)NC3=C(C=C(C=C3)NC4=CC=CC=C4)C

InChI

InChI=1S/C35H40N4O2S2/c1-26-24-30(36-28-10-5-3-6-11-28)14-16-32(26)38-34(40)18-22-42-20-9-21-43-23-19-35(41)39-33-17-15-31(25-27(33)2)37-29-12-7-4-8-13-29/h3-8,10-17,24-25,36-37H,9,18-23H2,1-2H3,(H,38,40)(H,39,41)