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

Systemtic Name: N-butan-2-yl-4-[(E)-[4-[(3-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-ylidene]methyl]benzamide Openeye Name: 4-[(E)-[4-(m-tolylmethyl)-3-oxo-1,4-benzothiazin-2-ylidene]methyl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-[(E)-[4-[(3-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzamide IUPAC Name: N-butan-2-yl-4-[(E)-[4-[(3-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-ylidene]methyl]benzamide Traditional Name: 4-[(E)-[3-keto-4-(3-methylbenzyl)-1,4-benzothiazin-2-ylidene]methyl]-N-sec-butyl-benzamide Formula: C28H28N2O2S MolecularWeight: 456.59912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C3=CC=CC=C3S2)CC4=CC=CC(=C4)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=C(C=C1)/C=C/2\C(=O)N(C3=CC=CC=C3S2)CC4=CC=CC(=C4)C

InChI

InChI=1S/C28H28N2O2S/c1-4-20(3)29-27(31)23-14-12-21(13-15-23)17-26-28(32)30(18-22-9-7-8-19(2)16-22)24-10-5-6-11-25(24)33-26/h5-17,20H,4,18H2,1-3H3,(H,29,31)/b26-17+