(1R,6S)-6-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-[[4-(2-naphthyl)thiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[[[4-(2-naphthalenyl)-2-thiazolyl]amino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-[[4-(2-naphthyl)thiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C21H17N2O3S- MolecularWeight: 377.43628

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4C=C3)C(=O)[O-]

Isomeric SMILES

C1C=CC[C@H]([C@H]1C(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4C=C3)C(=O)[O-]

InChI

InChI=1S/C21H18N2O3S/c24-19(16-7-3-4-8-17(16)20(25)26)23-21-22-18(12-27-21)15-10-9-13-5-1-2-6-14(13)11-15/h1-6,9-12,16-17H,7-8H2,(H,25,26)(H,22,23,24)/p-1/t16-,17+/m0/s1