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

Systemtic Name: 2-[4-[(2,5-dimethylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[4-[(2,5-dimethylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanamide CAS Name: 2-[4-[(2,5-dimethylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-[4-[(2,5-dimethylphenyl)methyl]-3-oxo-1,4-benzothiazin-2-yl]propanamide Traditional Name: N-benzyl-2-[4-(2,5-dimethylbenzyl)-3-keto-1,4-benzothiazin-2-yl]propionamide Formula: C27H28N2O2S MolecularWeight: 444.58842

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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=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3SC(C2=O)C(C)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2S/c1-18-13-14-19(2)22(15-18)17-29-23-11-7-8-12-24(23)32-25(27(29)31)20(3)26(30)28-16-21-9-5-4-6-10-21/h4-15,20,25H,16-17H2,1-3H3,(H,28,30)