N-(4-azanylcyclohexyl)-1-[2-(4-methoxyphenyl)ethanoyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-[2-(4-methoxyphenyl)ethanoyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-benzylsulfonyl-3-[2-(4-methoxyphenyl)acetyl]hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)-1-oxoethyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-benzylsulfonyl-3-[2-(4-methoxyphenyl)acetyl]-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-benzylsulfonyl-3-[2-(4-methoxyphenyl)acetyl]hexahydropyrimidine-2-carboxamide Formula: C27H36N4O5S MolecularWeight: 528.66354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O5S/c1-36-24-14-8-20(9-15-24)18-25(32)30-16-5-17-31(37(34,35)19-21-6-3-2-4-7-21)27(30)26(33)29-23-12-10-22(28)11-13-23/h2-4,6-9,14-15,22-23,27H,5,10-13,16-19,28H2,1H3,(H,29,33)