7-(4-methylpiperazin-1-yl)carbonyl-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(4-methylpiperazin-1-yl)carbonyl-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(4-methylpiperazine-1-carbonyl)-3-phenethyl-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[(4-methyl-1-piperazinyl)-oxomethyl]-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(4-methylpiperazine-1-carbonyl)-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(4-methylpiperazine-1-carbonyl)-3-phenethyl-2-thioxo-1H-quinazolin-4-one Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2S/c1-24-11-13-25(14-12-24)20(27)17-7-8-18-19(15-17)23-22(29)26(21(18)28)10-9-16-5-3-2-4-6-16/h2-8,15H,9-14H2,1H3,(H,23,29)