(1R,6S)-6-[[3-(furan-2-ylmethylcarbamoyl)thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[[3-(furan-2-ylmethylcarbamoyl)thiophen-2-yl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[[3-(2-furylmethylcarbamoyl)-2-thienyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[[3-[(2-furanylmethylamino)-oxomethyl]-2-thiophenyl]amino]-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[[3-(furan-2-ylmethylcarbamoyl)thiophen-2-yl]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[[3-(2-furfurylcarbamoyl)-2-thienyl]carbamoyl]-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C20H21N2O5S- MolecularWeight: 401.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC=CO3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)NC2=C(C=CS2)C(=O)NCC3=CC=CO3)C(=O)[O-])C

InChI

InChI=1S/C20H22N2O5S/c1-11-8-15(16(20(25)26)9-12(11)2)18(24)22-19-14(5-7-28-19)17(23)21-10-13-4-3-6-27-13/h3-7,15-16H,8-10H2,1-2H3,(H,21,23)(H,22,24)(H,25,26)/p-1/t15-,16+/m0/s1