N-(4-azanylcyclohexyl)-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-benzylsulfonyl-3-(5-methylisoxazole-3-carbonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(5-methyl-3-isoxazolyl)-oxomethyl]-3-(phenylmethyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-benzylsulfonyl-3-(5-methyl-1,2-oxazole-3-carbonyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-benzylsulfonyl-3-(5-methylisoxazole-3-carbonyl)hexahydropyrimidine-2-carboxamide Formula: C23H31N5O5S MolecularWeight: 489.58774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H31N5O5S/c1-16-14-20(26-33-16)23(30)27-12-5-13-28(34(31,32)15-17-6-3-2-4-7-17)22(27)21(29)25-19-10-8-18(24)9-11-19/h2-4,6-7,14,18-19,22H,5,8-13,15,24H2,1H3,(H,25,29)