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

Systemtic Name: 3-ethyl-7-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-ethyl-7-[4-(m-tolylmethyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-ethyl-7-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-ethyl-7-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-ethyl-7-[4-(3-methylbenzyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CC(=C4)C)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=CC(=C4)C)NC1=S

InChI

InChI=1S/C23H26N4O2S/c1-3-27-22(29)19-8-7-18(14-20(19)24-23(27)30)21(28)26-11-9-25(10-12-26)15-17-6-4-5-16(2)13-17/h4-8,13-14H,3,9-12,15H2,1-2H3,(H,24,30)