[2-oxidanylidene-2-[(5-oxidanylidene-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-oxidanylidene-2-[(5-oxidanylidene-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-oxo-2-[(5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-oxo-2-[(5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-keto-2-[(5-keto-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)amino]ethyl] ester Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=NC=C2C(=N1)CC(CC2=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=NC=C2C(=N1)CC(CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S2/c1-3-25(4-2)21(28)29-13-19(27)24-20-22-12-16-17(23-20)10-15(11-18(16)26)14-8-6-5-7-9-14/h5-9,12,15H,3-4,10-11,13H2,1-2H3,(H,22,23,24,27)