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

Systemtic Name: 2-methyl-3-[3-oxidanylidene-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 2-methyl-3-[3-oxo-3-[4-(3-thienylmethyl)piperazin-1-yl]propyl]quinazolin-4-one CAS Name: 2-methyl-3-[3-oxo-3-[4-(3-thiophenylmethyl)-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 2-methyl-3-[3-oxo-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 3-[3-keto-3-[4-(3-thenyl)piperazino]propyl]-2-methyl-quinazolin-4-one Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C21H24N4O2S/c1-16-22-19-5-3-2-4-18(19)21(27)25(16)8-6-20(26)24-11-9-23(10-12-24)14-17-7-13-28-15-17/h2-5,7,13,15H,6,8-12,14H2,1H3