4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-ylidene]methyl]-N-propyl-benzamide

Systemtic Name: 4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-ylidene]methyl]-N-propyl-benzamide Openeye Name: 4-[(E)-[4-(o-tolylmethyl)-3-oxo-1,4-benzothiazin-2-ylidene]methyl]-N-propyl-benzamide CAS Name: 4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]-N-propylbenzamide IUPAC Name: 4-[(E)-[4-[(2-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]-N-propylbenzamide Traditional Name: 4-[(E)-[3-keto-4-(2-methylbenzyl)-1,4-benzothiazin-2-ylidene]methyl]-N-propyl-benzamide Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C3=CC=CC=C3S2)CC4=CC=CC=C4C

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)/C=C/2\C(=O)N(C3=CC=CC=C3S2)CC4=CC=CC=C4C

InChI

InChI=1S/C27H26N2O2S/c1-3-16-28-26(30)21-14-12-20(13-15-21)17-25-27(31)29(18-22-9-5-4-8-19(22)2)23-10-6-7-11-24(23)32-25/h4-15,17H,3,16,18H2,1-2H3,(H,28,30)/b25-17+