N-(3-methylbutyl)-4-[(3-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-(3-methylbutyl)-4-[(3-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: N-isopentyl-4-(m-tolylmethyl)-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: N-(3-methylbutyl)-4-[(3-methylphenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(3-methylbutyl)-4-[(3-methylphenyl)methyl]-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: N-isoamyl-3-keto-4-(3-methylbenzyl)-1,4-benzothiazine-6-carboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=O)CSC3=C2C=C(C=C3)C(=O)NCCC(C)C

InChI

InChI=1S/C22H26N2O2S/c1-15(2)9-10-23-22(26)18-7-8-20-19(12-18)24(21(25)14-27-20)13-17-6-4-5-16(3)11-17/h4-8,11-12,15H,9-10,13-14H2,1-3H3,(H,23,26)