N-[(2R)-1-[(3-cyanophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[(2R)-1-[(3-cyanophenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[(1R)-1-[(3-cyanophenyl)carbamoyl]-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[(2R)-1-(3-cyanoanilino)-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[(2R)-1-(3-cyanoanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[(1R)-1-[(3-cyanophenyl)carbamoyl]-3-(methylthio)propyl]-4-methoxy-benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N[C@H](CCSC)C(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C20H21N3O3S/c1-26-17-8-6-15(7-9-17)19(24)23-18(10-11-27-2)20(25)22-16-5-3-4-14(12-16)13-21/h3-9,12,18H,10-11H2,1-2H3,(H,22,25)(H,23,24)/t18-/m1/s1