N-[2-(4-chlorophenyl)ethyl]-4-oxidanylidene-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-oxidanylidene-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-oxo-3-propyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-oxo-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-oxo-3-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-keto-3-propyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCCC3=CC=C(C=C3)Cl)NC1=S

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCCC3=CC=C(C=C3)Cl)NC1=S

InChI

InChI=1S/C20H20ClN3O2S/c1-2-11-24-19(26)16-8-5-14(12-17(16)23-20(24)27)18(25)22-10-9-13-3-6-15(21)7-4-13/h3-8,12H,2,9-11H2,1H3,(H,22,25)(H,23,27)