(3R,4R)-4-(4-methoxyphenyl)-1-(4-oxidanylcyclohexyl)-3-sulfanyl-azetidin-2-one

Systemtic Name: (3R,4R)-4-(4-methoxyphenyl)-1-(4-oxidanylcyclohexyl)-3-sulfanyl-azetidin-2-one Openeye Name: (3R,4R)-1-(4-hydroxycyclohexyl)-4-(4-methoxyphenyl)-3-sulfanyl-azetidin-2-one CAS Name: (3R,4R)-1-(4-hydroxycyclohexyl)-3-mercapto-4-(4-methoxyphenyl)-2-azetidinone IUPAC Name: (3R,4R)-1-(4-hydroxycyclohexyl)-4-(4-methoxyphenyl)-3-sulfanylazetidin-2-one Traditional Name: (3R,4R)-1-(4-hydroxycyclohexyl)-3-mercapto-4-(4-methoxyphenyl)azetidin-2-one Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=O)N2C3CCC(CC3)O)S

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H](C(=O)N2C3CCC(CC3)O)S

InChI

InChI=1S/C16H21NO3S/c1-20-13-8-2-10(3-9-13)14-15(21)16(19)17(14)11-4-6-12(18)7-5-11/h2-3,8-9,11-12,14-15,18,21H,4-7H2,1H3/t11?,12?,14-,15-/m1/s1