1-(3,3-dimethyl-10-phenyl-2,4-dihydropyrimido[1,2-a]indol-10-yl)-3-(4-methylphenyl)sulfonyl-urea chloride

Systemtic Name: 1-(3,3-dimethyl-10-phenyl-2,4-dihydropyrimido[1,2-a]indol-10-yl)-3-(4-methylphenyl)sulfonyl-urea chloride Openeye Name: 1-(3,3-dimethyl-10-phenyl-2,4-dihydropyrimido[1,2-a]indol-10-yl)-3-(p-tolylsulfonyl)urea chloride CAS Name: 1-(3,3-dimethyl-10-phenyl-2,4-dihydropyrimido[1,2-a]indol-10-yl)-3-(4-methylphenyl)sulfonylurea chloride IUPAC Name: 1-(3,3-dimethyl-10-phenyl-2,4-dihydropyrimido[1,2-a]indol-10-yl)-3-(4-methylphenyl)sulfonylurea chloride Traditional Name: 1-(3,3-dimethyl-10-phenyl-2,4-dihydropyrimid[1,2-a]indol-10-yl)-3-tosyl-urea chloride Formula: C27H28ClN4O3S- MolecularWeight: 524.05422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2(C3=CC=CC=C3N4C2=NCC(C4)(C)C)C5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2(C3=CC=CC=C3N4C2=NCC(C4)(C)C)C5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C27H28N4O3S.ClH/c1-19-13-15-21(16-14-19)35(33,34)30-25(32)29-27(20-9-5-4-6-10-20)22-11-7-8-12-23(22)31-18-26(2,3)17-28-24(27)31;/h4-16H,17-18H2,1-3H3,(H2,29,30,32);1H/p-1