N-[2-(cyclohexen-1-yl)ethyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCC1=CCCCC1)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)NCCC1=CCCCC1)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H30N2O3S/c1-27-15-13-19(21(25)22-14-12-17-8-4-2-5-9-17)23-20(24)16-26-18-10-6-3-7-11-18/h3,6-8,10-11,19H,2,4-5,9,12-16H2,1H3,(H,22,25)(H,23,24)