(1R,6S)-6-[[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[[3-cyano-4-(4-isopropylphenyl)-5-methyl-2-thienyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[[3-cyano-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[(3-cyano-5-methyl-4-p-cumenyl-2-thienyl)carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C25H27N2O3S- MolecularWeight: 435.55848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)C(C)C)C#N)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)C(C)C)C#N)C(=O)[O-])C

InChI

InChI=1S/C25H28N2O3S/c1-13(2)17-6-8-18(9-7-17)22-16(5)31-24(21(22)12-26)27-23(28)19-10-14(3)15(4)11-20(19)25(29)30/h6-9,13,19-20H,10-11H2,1-5H3,(H,27,28)(H,29,30)/p-1/t19-,20+/m0/s1