N-[3-(diethylaminomethyl)phenyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3-(diethylaminomethyl)phenyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[3-(diethylaminomethyl)phenyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-(diethylaminomethyl)phenyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-(diethylaminomethyl)phenyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[3-(diethylaminomethyl)phenyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3

InChI

InChI=1S/C20H22N4O2S/c1-3-24(4-2)12-13-6-5-7-15(10-13)21-18(25)14-8-9-16-17(11-14)22-20(27)23-19(16)26/h5-11H,3-4,12H2,1-2H3,(H,21,25)(H2,22,23,26,27)