N-(3-chloranyl-4-propan-2-yloxy-phenyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: N-(3-chloranyl-4-propan-2-yloxy-phenyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: N-(3-chloro-4-isopropoxy-phenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: N-(3-chloro-4-propan-2-yloxyphenyl)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: N-(3-chloro-4-propan-2-yloxyphenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: N-(3-chloro-4-isopropoxy-phenyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2)Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-15(2)29-20-10-9-16(13-18(20)23)24-22(27)19(11-12-30-3)25-21(26)14-28-17-7-5-4-6-8-17/h4-10,13,15,19H,11-12,14H2,1-3H3,(H,24,27)(H,25,26)