(1R,2S)-2-[[3-aminocarbonyl-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[[3-aminocarbonyl-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[[3-carbamoyl-4-(4-isopropylphenyl)-5-methyl-2-thienyl]carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[[3-carbamoyl-5-methyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[[3-carbamoyl-5-methyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[(3-carbamoyl-5-methyl-4-p-cumenyl-2-thienyl)carbamoyl]cyclohexanecarboxylate Formula: C23H27N2O4S- MolecularWeight: 427.53648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2CCCCC2C(=O)[O-])C(=O)N)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])C(=O)N)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C23H28N2O4S/c1-12(2)14-8-10-15(11-9-14)18-13(3)30-22(19(18)20(24)26)25-21(27)16-6-4-5-7-17(16)23(28)29/h8-12,16-17H,4-7H2,1-3H3,(H2,24,26)(H,25,27)(H,28,29)/p-1/t16-,17+/m0/s1