N-[[1-(N'-cyclopropyl-N-methylsulfonyl-carbamimidoyl)-4-phenyl-piperidin-4-yl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[1-(N'-cyclopropyl-N-methylsulfonyl-carbamimidoyl)-4-phenyl-piperidin-4-yl]methyl]-2-methoxy-benzamide Openeye Name: N-[[1-(N'-cyclopropyl-N-methylsulfonyl-carbamimidoyl)-4-phenyl-4-piperidyl]methyl]-2-methoxy-benzamide CAS Name: N-[[1-[cyclopropylimino(methanesulfonamido)methyl]-4-phenyl-4-piperidinyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[1-(N'-cyclopropyl-N-methylsulfonylcarbamimidoyl)-4-phenylpiperidin-4-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[1-(N'-cyclopropyl-N-mesyl-amidino)-4-phenyl-4-piperidyl]methyl]-2-methoxy-benzamide Formula: C25H32N4O4S MolecularWeight: 484.61098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NC3CC3)NS(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=NC3CC3)NS(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4O4S/c1-33-22-11-7-6-10-21(22)23(30)26-18-25(19-8-4-3-5-9-19)14-16-29(17-15-25)24(27-20-12-13-20)28-34(2,31)32/h3-11,20H,12-18H2,1-2H3,(H,26,30)(H,27,28)