2-[4-[(2,5-dimethylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 2-[4-[(2,5-dimethylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 2-[4-[(2,5-dimethylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]-N-(2-thienylmethyl)propanamide CAS Name: 2-[4-[(2,5-dimethylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 2-[4-[(2,5-dimethylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 2-[4-(2,5-dimethylbenzyl)-3-keto-1,4-benzothiazin-2-yl]-N-(2-thenyl)propionamide Formula: C25H26N2O2S2 MolecularWeight: 450.61614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3SC(C2=O)C(C)C(=O)NCC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3SC(C2=O)C(C)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C25H26N2O2S2/c1-16-10-11-17(2)19(13-16)15-27-21-8-4-5-9-22(21)31-23(25(27)29)18(3)24(28)26-14-20-7-6-12-30-20/h4-13,18,23H,14-15H2,1-3H3,(H,26,28)