(1S,6S)-6-[(3-ethoxycarbonyl-4-thiophen-2-yl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6S)-6-[(3-ethoxycarbonyl-4-thiophen-2-yl-thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6S)-6-[[3-ethoxycarbonyl-4-(2-thienyl)-2-thienyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6S)-6-[[(3-ethoxycarbonyl-4-thiophen-2-yl-2-thiophenyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6S)-6-[(3-ethoxycarbonyl-4-thiophen-2-ylthiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6S)-6-[[3-carbethoxy-4-(2-thienyl)-2-thienyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C19H18NO5S2- MolecularWeight: 404.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-]

InChI

InChI=1S/C19H19NO5S2/c1-2-25-19(24)15-13(14-8-5-9-26-14)10-27-17(15)20-16(21)11-6-3-4-7-12(11)18(22)23/h3-5,8-12H,2,6-7H2,1H3,(H,20,21)(H,22,23)/p-1/t11-,12-/m0/s1