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

Systemtic Name: N-(4-azanylcyclohexyl)-1-[2-(4-methoxyphenyl)ethanoyl]-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)acetyl]-3-(2-thienylsulfonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)-1-oxoethyl]-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)acetyl]-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-[2-(4-methoxyphenyl)acetyl]-3-(2-thienylsulfonyl)hexahydropyrimidine-2-carboxamide Formula: C24H32N4O5S2 MolecularWeight: 520.66468

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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)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N2CCCN(C2C(=O)NC3CCC(CC3)N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C24H32N4O5S2/c1-33-20-11-5-17(6-12-20)16-21(29)27-13-3-14-28(35(31,32)22-4-2-15-34-22)24(27)23(30)26-19-9-7-18(25)8-10-19/h2,4-6,11-12,15,18-19,24H,3,7-10,13-14,16,25H2,1H3,(H,26,30)