N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3-morpholinopropyl)-4-oxo-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-(3-morpholinopropyl)-3-phenyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c27-20(23-9-4-10-25-11-13-29-14-12-25)16-7-8-18-19(15-16)24-22(30)26(21(18)28)17-5-2-1-3-6-17/h1-3,5-8,15H,4,9-14H2,(H,23,27)(H,24,30)