7-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-ethyl-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-ethyl-2-thioxo-1H-quinazolin-4-one Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)NC1=S

InChI

InChI=1S/C21H21ClN4O2S/c1-2-26-20(28)17-7-6-14(12-18(17)23-21(26)29)19(27)25-10-8-24(9-11-25)16-5-3-4-15(22)13-16/h3-7,12-13H,2,8-11H2,1H3,(H,23,29)