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

Systemtic Name: N-(4-azanylcyclohexyl)-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(5-methylisoxazole-3-carbonyl)-3-(2-thienylsulfonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(5-methyl-3-isoxazolyl)-oxomethyl]-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(5-methyl-1,2-oxazole-3-carbonyl)-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(5-methylisoxazole-3-carbonyl)-3-(2-thienylsulfonyl)hexahydropyrimidine-2-carboxamide Formula: C20H27N5O5S2 MolecularWeight: 481.58888

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)C4=CC=CS4

Isomeric SMILES

CC1=CC(=NO1)C(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H27N5O5S2/c1-13-12-16(23-30-13)20(27)24-9-3-10-25(32(28,29)17-4-2-11-31-17)19(24)18(26)22-15-7-5-14(21)6-8-15/h2,4,11-12,14-15,19H,3,5-10,21H2,1H3,(H,22,26)