N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[(4-ethylphenyl)-thiophen-2-yl-methyl]-3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[(4-ethylphenyl)-thiophen-2-ylmethyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[(4-ethylphenyl)-(2-thienyl)methyl]-3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C4=CC=CC=C4OC(C3=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C4=CC=CC=C4OC(C3=O)C

InChI

InChI=1S/C25H26N2O3S/c1-3-18-10-12-19(13-11-18)24(22-9-6-16-31-22)26-23(28)14-15-27-20-7-4-5-8-21(20)30-17(2)25(27)29/h4-13,16-17,24H,3,14-15H2,1-2H3,(H,26,28)