3-[4-[2-(2-methylphenyl)imino-4H-3,1-benzothiazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one

Systemtic Name: 3-[4-[2-(2-methylphenyl)imino-4H-3,1-benzothiazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one Openeye Name: 3-[4-[2-(o-tolylimino)-4H-3,1-benzothiazin-1-yl]-4-oxo-butyl]quinazolin-4-one CAS Name: 3-[4-[2-(2-methylphenyl)imino-4H-3,1-benzothiazin-1-yl]-4-oxobutyl]-4-quinazolinone IUPAC Name: 3-[4-[2-(2-methylphenyl)imino-4H-3,1-benzothiazin-1-yl]-4-oxobutyl]quinazolin-4-one Traditional Name: 3-[4-keto-4-[2-(o-tolylimino)-4H-3,1-benzothiazin-1-yl]butyl]quinazolin-4-one Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=C2N(C3=CC=CC=C3CS2)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=CC=C1N=C2N(C3=CC=CC=C3CS2)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C27H24N4O2S/c1-19-9-2-5-12-22(19)29-27-31(24-14-7-3-10-20(24)17-34-27)25(32)15-8-16-30-18-28-23-13-6-4-11-21(23)26(30)33/h2-7,9-14,18H,8,15-17H2,1H3