N-(4-azanylcyclohexyl)-1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-(2-thienylsulfonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-3-thiophen-2-ylsulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-(2-thienylsulfonyl)hexahydropyrimidine-2-carboxamide Formula: C24H36N6O4S2 MolecularWeight: 536.71044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H36N6O4S2/c1-24(2,3)19-15-18(28(4)27-19)23(32)29-12-6-13-30(36(33,34)20-7-5-14-35-20)22(29)21(31)26-17-10-8-16(25)9-11-17/h5,7,14-17,22H,6,8-13,25H2,1-4H3,(H,26,31)