2-[3-(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)prop-2-ynyl-methyl-amino]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 2-[3-(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)prop-2-ynyl-methyl-amino]-N,N-dimethyl-benzenesulfonamide Openeye Name: 2-[3-(2-amino-4-oxo-1H-quinazolin-6-yl)prop-2-ynyl-methyl-amino]-N,N-dimethyl-benzenesulfonamide CAS Name: 2-[3-(2-amino-4-oxo-1H-quinazolin-6-yl)prop-2-ynyl-methylamino]-N,N-dimethylbenzenesulfonamide IUPAC Name: 2-[3-(2-amino-4-oxo-1H-quinazolin-6-yl)prop-2-ynyl-methylamino]-N,N-dimethylbenzenesulfonamide Traditional Name: 2-[3-(2-amino-4-keto-1H-quinazolin-6-yl)prop-2-ynyl-methyl-amino]-N,N-dimethyl-benzenesulfonamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC=C1N(C)CC#CC2=CC3=C(C=C2)NC(=NC3=O)N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC=C1N(C)CC#CC2=CC3=C(C=C2)NC(=NC3=O)N

InChI

InChI=1S/C20H21N5O3S/c1-24(2)29(27,28)18-9-5-4-8-17(18)25(3)12-6-7-14-10-11-16-15(13-14)19(26)23-20(21)22-16/h4-5,8-11,13H,12H2,1-3H3,(H3,21,22,23,26)