[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-phenyl-methanone

Systemtic Name: [3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-phenyl-methanone Openeye Name: [2-isopropyl-3-(p-tolylsulfonyl)hexahydropyrimidin-1-yl]-phenyl-methanone CAS Name: [3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-phenylmethanone IUPAC Name: [3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-phenylmethanone Traditional Name: (2-isopropyl-3-tosyl-hexahydropyrimidin-1-yl)-phenyl-methanone Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S/c1-16(2)20-22(21(24)18-8-5-4-6-9-18)14-7-15-23(20)27(25,26)19-12-10-17(3)11-13-19/h4-6,8-13,16,20H,7,14-15H2,1-3H3