N-[(4-ethylphenyl)methyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)-N-(pyridin-3-ylmethyl)propanamide Openeye Name: N-[(4-ethylphenyl)methyl]-3-(3-oxo-1,4-benzothiazin-4-yl)-N-(3-pyridylmethyl)propanamide CAS Name: N-[(4-ethylphenyl)methyl]-3-(3-oxo-1,4-benzothiazin-4-yl)-N-(3-pyridinylmethyl)propanamide IUPAC Name: N-[(4-ethylphenyl)methyl]-3-(3-oxo-1,4-benzothiazin-4-yl)-N-(pyridin-3-ylmethyl)propanamide Traditional Name: N-(4-ethylbenzyl)-3-(3-keto-1,4-benzothiazin-4-yl)-N-(3-pyridylmethyl)propionamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)C(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C26H27N3O2S/c1-2-20-9-11-21(12-10-20)17-28(18-22-6-5-14-27-16-22)25(30)13-15-29-23-7-3-4-8-24(23)32-19-26(29)31/h3-12,14,16H,2,13,15,17-19H2,1H3