N-[(2S)-1-[(3-chloranyl-4-methyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[(2S)-1-[(3-chloranyl-4-methyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[(1S)-1-[(3-chloro-4-methyl-phenyl)carbamoyl]-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[(2S)-1-(3-chloro-4-methylanilino)-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[(2S)-1-(3-chloro-4-methylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[(1S)-1-[(3-chloro-4-methyl-phenyl)carbamoyl]-3-(methylthio)propyl]-4-methoxy-benzamide Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=C(C=C2)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=C(C=C2)OC)Cl

InChI

InChI=1S/C20H23ClN2O3S/c1-13-4-7-15(12-17(13)21)22-20(25)18(10-11-27-3)23-19(24)14-5-8-16(26-2)9-6-14/h4-9,12,18H,10-11H2,1-3H3,(H,22,25)(H,23,24)/t18-/m0/s1