N-[2,5-diethoxy-4-(2-thiophen-2-ylethanoylamino)phenyl]-3-methyl-butanamide

Systemtic Name: N-[2,5-diethoxy-4-(2-thiophen-2-ylethanoylamino)phenyl]-3-methyl-butanamide Openeye Name: N-[2,5-diethoxy-4-[[2-(2-thienyl)acetyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[2,5-diethoxy-4-[(1-oxo-2-thiophen-2-ylethyl)amino]phenyl]-3-methylbutanamide IUPAC Name: N-[2,5-diethoxy-4-[(2-thiophen-2-ylacetyl)amino]phenyl]-3-methylbutanamide Traditional Name: N-[2,5-diethoxy-4-[[2-(2-thienyl)acetyl]amino]phenyl]-3-methyl-butyramide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)CC2=CC=CS2)OCC)NC(=O)CC(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)CC2=CC=CS2)OCC)NC(=O)CC(C)C

InChI

InChI=1S/C21H28N2O4S/c1-5-26-18-13-17(23-21(25)11-15-8-7-9-28-15)19(27-6-2)12-16(18)22-20(24)10-14(3)4/h7-9,12-14H,5-6,10-11H2,1-4H3,(H,22,24)(H,23,25)