prop-2-enyl 6-methoxy-3,3-dimethyl-4-pyridin-2-ylsulfanyl-4H-quinoline-2-carboxylate

Systemtic Name: prop-2-enyl 6-methoxy-3,3-dimethyl-4-pyridin-2-ylsulfanyl-4H-quinoline-2-carboxylate Openeye Name: allyl 6-methoxy-3,3-dimethyl-4-(2-pyridylsulfanyl)-4H-quinoline-2-carboxylate CAS Name: 6-methoxy-3,3-dimethyl-4-(2-pyridinylthio)-4H-quinoline-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 6-methoxy-3,3-dimethyl-4-pyridin-2-ylsulfanyl-4H-quinoline-2-carboxylate Traditional Name: 6-methoxy-3,3-dimethyl-4-(2-pyridylthio)-4H-quinoline-2-carboxylic acid allyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=C(C=CC(=C2)OC)N=C1C(=O)OCC=C)SC3=CC=CC=N3)C

Isomeric SMILES

CC1(C(C2=C(C=CC(=C2)OC)N=C1C(=O)OCC=C)SC3=CC=CC=N3)C

InChI

InChI=1S/C21H22N2O3S/c1-5-12-26-20(24)18-21(2,3)19(27-17-8-6-7-11-22-17)15-13-14(25-4)9-10-16(15)23-18/h5-11,13,19H,1,12H2,2-4H3