3-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[[4-[(4-methyl-1-piperidyl)methyl]phenyl]methyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[[4-[(4-methyl-1-piperidinyl)methyl]phenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[4-[(4-methylpiperidino)methyl]benzyl]-2-thioxo-1H-quinazolin-4-one Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CC1CCN(CC1)CC2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C22H25N3OS/c1-16-10-12-24(13-11-16)14-17-6-8-18(9-7-17)15-25-21(26)19-4-2-3-5-20(19)23-22(25)27/h2-9,16H,10-15H2,1H3,(H,23,27)