3-cyclopropyl-2-[2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-cyclopropyl-2-[2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[2-[4-(o-tolylmethyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopropyl-2-[[2-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopropyl-2-[[2-keto-2-[4-(2-methylbenzyl)piperazino]ethyl]thio]quinazolin-4-one Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5

InChI

InChI=1S/C25H28N4O2S/c1-18-6-2-3-7-19(18)16-27-12-14-28(15-13-27)23(30)17-32-25-26-22-9-5-4-8-21(22)24(31)29(25)20-10-11-20/h2-9,20H,10-17H2,1H3