(1S)-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]cyclohex-3-ene-1-carboxamide

Systemtic Name: (1S)-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]cyclohex-3-ene-1-carboxamide Openeye Name: (1S)-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]cyclohex-3-ene-1-carboxamide CAS Name: (1S)-N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-2-thiazolyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1S)-N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-1,3-thiazol-2-yl]cyclohex-3-ene-1-carboxamide Traditional Name: (1S)-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]cyclohex-3-ene-1-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CCC=CC3)CC#N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)[C@H]3CCC=CC3)CC#N

InChI

InChI=1S/C19H19N3O2S/c1-24-17-8-7-14(11-15(17)9-10-20)16-12-25-19(21-16)22-18(23)13-5-3-2-4-6-13/h2-3,7-8,11-13H,4-6,9H2,1H3,(H,21,22,23)/t13-/m1/s1