N-[3-(diethylaminomethyl)phenyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[3-(diethylaminomethyl)phenyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[3-(diethylaminomethyl)phenyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[3-(diethylaminomethyl)phenyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[3-(diethylaminomethyl)phenyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[3-(diethylaminomethyl)phenyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC(=CC=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCN(CC)CC1=CC(=CC=C1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C22H26N4O2S/c1-3-25(4-2)15-16-8-7-9-17(14-16)23-20(27)12-13-26-21(28)18-10-5-6-11-19(18)24-22(26)29/h5-11,14H,3-4,12-13,15H2,1-2H3,(H,23,27)(H,24,29)