(2Z)-4-[(3-methylphenyl)methyl]-2-(phenylmethylidene)-6-pyrrolidin-1-ylcarbonyl-1,4-benzothiazin-3-one

Systemtic Name: (2Z)-4-[(3-methylphenyl)methyl]-2-(phenylmethylidene)-6-pyrrolidin-1-ylcarbonyl-1,4-benzothiazin-3-one Openeye Name: (2Z)-2-benzylidene-4-(m-tolylmethyl)-6-(pyrrolidine-1-carbonyl)-1,4-benzothiazin-3-one CAS Name: (2Z)-4-[(3-methylphenyl)methyl]-6-[oxo(1-pyrrolidinyl)methyl]-2-(phenylmethylene)-1,4-benzothiazin-3-one IUPAC Name: (2Z)-2-benzylidene-4-[(3-methylphenyl)methyl]-6-(pyrrolidine-1-carbonyl)-1,4-benzothiazin-3-one Traditional Name: (2Z)-2-benzal-4-(3-methylbenzyl)-6-(pyrrolidine-1-carbonyl)-1,4-benzothiazin-3-one Formula: C28H26N2O2S MolecularWeight: 454.58324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C3=C(C=CC(=C3)C(=O)N4CCCC4)SC(=CC5=CC=CC=C5)C2=O

Isomeric SMILES

CC1=CC(=CC=C1)CN2C3=C(C=CC(=C3)C(=O)N4CCCC4)S/C(=C\C5=CC=CC=C5)/C2=O

InChI

InChI=1S/C28H26N2O2S/c1-20-8-7-11-22(16-20)19-30-24-18-23(27(31)29-14-5-6-15-29)12-13-25(24)33-26(28(30)32)17-21-9-3-2-4-10-21/h2-4,7-13,16-18H,5-6,14-15,19H2,1H3/b26-17-