6-bromanyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 6-bromo-2-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3-phenyl-quinazolin-4-one CAS Name: 6-bromo-2-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-3-phenyl-4-quinazolinone IUPAC Name: 6-bromo-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-phenylquinazolin-4-one Traditional Name: 6-bromo-2-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-3-phenyl-quinazolin-4-one Formula: C22H22BrN3O2S MolecularWeight: 472.39798

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C22H22BrN3O2S/c1-15-9-11-25(12-10-15)20(27)14-29-22-24-19-8-7-16(23)13-18(19)21(28)26(22)17-5-3-2-4-6-17/h2-8,13,15H,9-12,14H2,1H3