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

Systemtic Name: 3-methyl-7-[4-[(3-methylphenyl)methyl]piperazin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-methyl-7-[4-(m-tolylmethyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-methyl-7-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-methyl-7-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-methyl-7-[4-(3-methylbenzyl)piperazine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)C

InChI

InChI=1S/C22H24N4O2S/c1-15-4-3-5-16(12-15)14-25-8-10-26(11-9-25)20(27)17-6-7-18-19(13-17)23-22(29)24(2)21(18)28/h3-7,12-13H,8-11,14H2,1-2H3,(H,23,29)