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

Systemtic Name: N-[(2R)-1-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[(1R)-1-[[2-(cyclopropylamino)-2-oxo-ethyl]carbamoyl]-3-methylsulfanyl-propyl]-4-methoxy-benzamide CAS Name: N-[(2R)-1-[[2-(cyclopropylamino)-2-oxoethyl]amino]-4-(methylthio)-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[(2R)-1-[[2-(cyclopropylamino)-2-oxoethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[(1R)-1-[[2-(cyclopropylamino)-2-keto-ethyl]carbamoyl]-3-(methylthio)propyl]-4-methoxy-benzamide Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O4S/c1-25-14-7-3-12(4-8-14)17(23)21-15(9-10-26-2)18(24)19-11-16(22)20-13-5-6-13/h3-4,7-8,13,15H,5-6,9-11H2,1-2H3,(H,19,24)(H,20,22)(H,21,23)/t15-/m1/s1