N-[(2S)-1-[(4-ethoxyphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[(2S)-1-[(4-ethoxyphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[(1S)-1-[(4-ethoxyphenyl)carbamoyl]-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[(2S)-1-(4-ethoxyanilino)-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[(2S)-1-(4-ethoxyanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: 4-methoxy-N-[(1S)-3-(methylthio)-1-(p-phenetylcarbamoyl)propyl]benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N2O4S/c1-4-27-18-11-7-16(8-12-18)22-21(25)19(13-14-28-3)23-20(24)15-5-9-17(26-2)10-6-15/h5-12,19H,4,13-14H2,1-3H3,(H,22,25)(H,23,24)/t19-/m0/s1