prop-2-enyl 6-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: prop-2-enyl 6-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: allyl 6-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: 6-[[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: 6-[(6-ethoxy-1,3-benzothiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid allyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC=CCC3C(=O)OCC=C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC=CCC3C(=O)OCC=C

InChI

InChI=1S/C20H22N2O4S/c1-3-11-26-19(24)15-8-6-5-7-14(15)18(23)22-20-21-16-10-9-13(25-4-2)12-17(16)27-20/h3,5-6,9-10,12,14-15H,1,4,7-8,11H2,2H3,(H,21,22,23)