N-[1-[(4-cyanophenyl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[1-[(4-cyanophenyl)methylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[(4-cyanophenyl)methylcarbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[(4-cyanophenyl)methylamino]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[(4-cyanophenyl)methylamino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-[(4-cyanobenzyl)carbamoyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC2=CC=C(C=C2)C#N

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H23N3O3S/c1-27-19-6-4-3-5-17(19)20(25)24-18(11-12-28-2)21(26)23-14-16-9-7-15(13-22)8-10-16/h3-10,18H,11-12,14H2,1-2H3,(H,23,26)(H,24,25)