N-(2-azanylethyl)-1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonyl-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-(3,4-dichlorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(5-tert-butyl-2-methylpyrazole-3-carbonyl)-3-(3,4-dichlorophenyl)sulfonyl-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)-3-(3,4-dichlorophenyl)sulfonyl-hexahydropyrimidine-2-carboxamide Formula: C22H30Cl2N6O4S MolecularWeight: 545.4824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCN(C2C(=O)NCCN)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C22H30Cl2N6O4S/c1-22(2,3)18-13-17(28(4)27-18)21(32)29-10-5-11-30(20(29)19(31)26-9-8-25)35(33,34)14-6-7-15(23)16(24)12-14/h6-7,12-13,20H,5,8-11,25H2,1-4H3,(H,26,31)