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

Systemtic Name: N-[(2R)-1-(cyclopropylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[(1R)-1-(cyclopropylcarbamoyl)-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[(2R)-1-(cyclopropylamino)-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[(2R)-1-(cyclopropylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[(1R)-1-(cyclopropylcarbamoyl)-3-(methylthio)propyl]-4-methoxy-benzamide Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)NC2CC2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N[C@H](CCSC)C(=O)NC2CC2

InChI

InChI=1S/C16H22N2O3S/c1-21-13-7-3-11(4-8-13)15(19)18-14(9-10-22-2)16(20)17-12-5-6-12/h3-4,7-8,12,14H,5-6,9-10H2,1-2H3,(H,17,20)(H,18,19)/t14-/m1/s1