N-(2-dimethylaminoethyl)-N-[1-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]octane-1-sulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-[1-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]octane-1-sulfonamide Openeye Name: N-(2-dimethylaminoethyl)-N-[1-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]octane-1-sulfonamide CAS Name: N-(2-dimethylaminoethyl)-N-[1-[3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-1-octanesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-N-[1-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]octane-1-sulfonamide Traditional Name: N-(2-dimethylaminoethyl)-N-[1-[4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]ethyl]octane-1-sulfonamide Formula: C29H42N4O4S MolecularWeight: 542.73318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N(CCN(C)C)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCCS(=O)(=O)N(CCN(C)C)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

InChI

InChI=1S/C29H42N4O4S/c1-6-7-8-9-10-13-22-38(35,36)32(21-20-31(3)4)23(2)28-30-27-15-12-11-14-26(27)29(34)33(28)24-16-18-25(37-5)19-17-24/h11-12,14-19,23H,6-10,13,20-22H2,1-5H3