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

Systemtic Name: N-[(2R)-1-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[(1R)-1-[[2-(cyclopropylamino)-2-oxo-ethyl]carbamoyl]-3-methylsulfonyl-propyl]-2-methoxy-benzamide CAS Name: N-[(2R)-1-[[2-(cyclopropylamino)-2-oxoethyl]amino]-4-methylsulfonyl-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[(2R)-1-[[2-(cyclopropylamino)-2-oxoethyl]amino]-4-methylsulfonyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[(1R)-1-[[2-(cyclopropylamino)-2-keto-ethyl]carbamoyl]-3-mesyl-propyl]-2-methoxy-benzamide Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCS(=O)(=O)C)C(=O)NCC(=O)NC2CC2

Isomeric SMILES

COC1=CC=CC=C1C(=O)N[C@H](CCS(=O)(=O)C)C(=O)NCC(=O)NC2CC2

InChI

InChI=1S/C18H25N3O6S/c1-27-15-6-4-3-5-13(15)17(23)21-14(9-10-28(2,25)26)18(24)19-11-16(22)20-12-7-8-12/h3-6,12,14H,7-11H2,1-2H3,(H,19,24)(H,20,22)(H,21,23)/t14-/m1/s1