4-chloranyl-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-isopentyl-N-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]benzenesulfonamide CAS Name: 4-chloro-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]benzenesulfonamide Traditional Name: 4-chloro-N-isoamyl-N-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]benzenesulfonamide Formula: C28H30ClN3O3S MolecularWeight: 524.0741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H30ClN3O3S/c1-19(2)17-18-31(36(34,35)24-15-11-22(29)12-16-24)21(4)27-30-26-8-6-5-7-25(26)28(33)32(27)23-13-9-20(3)10-14-23/h5-16,19,21H,17-18H2,1-4H3