2-[3-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3-methyl-quinazolin-4-one

Systemtic Name: 2-[3-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3-methyl-quinazolin-4-one Openeye Name: 2-[3-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-3-oxo-propyl]-3-methyl-quinazolin-4-one CAS Name: 2-[3-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-3-oxopropyl]-3-methyl-4-quinazolinone IUPAC Name: 2-[3-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-3-oxopropyl]-3-methylquinazolin-4-one Traditional Name: 2-[3-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-3-keto-propyl]-3-methyl-quinazolin-4-one Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H25N5O2S/c1-27-21(25-18-7-3-2-6-17(18)24(27)31)10-11-23(30)29-14-12-28(13-15-29)16-22-26-19-8-4-5-9-20(19)32-22/h2-9H,10-16H2,1H3