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

Systemtic Name: N-[(2R)-1-(cycloheptylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[(1R)-1-(cycloheptylcarbamoyl)-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[(2R)-1-(cycloheptylamino)-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[(2R)-1-(cycloheptylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[(1R)-1-(cycloheptylcarbamoyl)-3-(methylthio)propyl]-4-methoxy-benzamide Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NC2CCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N[C@H](CCSC)C(=O)NC2CCCCCC2

InChI

InChI=1S/C20H30N2O3S/c1-25-17-11-9-15(10-12-17)19(23)22-18(13-14-26-2)20(24)21-16-7-5-3-4-6-8-16/h9-12,16,18H,3-8,13-14H2,1-2H3,(H,21,24)(H,22,23)/t18-/m1/s1