3-(4-methylphenyl)sulfonyl-N-phenyl-2-propan-2-yl-1,3-diazinane-1-carboxamide

Systemtic Name: 3-(4-methylphenyl)sulfonyl-N-phenyl-2-propan-2-yl-1,3-diazinane-1-carboxamide Openeye Name: 2-isopropyl-N-phenyl-3-(p-tolylsulfonyl)hexahydropyrimidine-1-carboxamide CAS Name: 3-(4-methylphenyl)sulfonyl-N-phenyl-2-propan-2-yl-1,3-diazinane-1-carboxamide IUPAC Name: 3-(4-methylphenyl)sulfonyl-N-phenyl-2-propan-2-yl-1,3-diazinane-1-carboxamide Traditional Name: 2-isopropyl-N-phenyl-3-tosyl-hexahydropyrimidine-1-carboxamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2C(C)C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C2C(C)C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-16(2)20-23(21(25)22-18-8-5-4-6-9-18)14-7-15-24(20)28(26,27)19-12-10-17(3)11-13-19/h4-6,8-13,16,20H,7,14-15H2,1-3H3,(H,22,25)