diethyl 2,6-dimethyl-3-phenyl-4-(1,3-thiazol-2-yl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate; fluoranylbenzene

Systemtic Name: diethyl 2,6-dimethyl-3-phenyl-4-(1,3-thiazol-2-yl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate; fluoranylbenzene Openeye Name: diethyl 2,6-dimethyl-3-phenyl-4-thiazol-2-yl-2,4-dihydro-1H-pyridine-3,5-dicarboxylate; fluorobenzene CAS Name: 2,6-dimethyl-3-phenyl-4-(2-thiazolyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid diethyl ester; fluorobenzene IUPAC Name: diethyl 2,6-dimethyl-3-phenyl-4-(1,3-thiazol-2-yl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylate; fluorobenzene Traditional Name: 2,6-dimethyl-3-phenyl-4-thiazol-2-yl-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid diethyl ester; fluorobenzene Formula: C28H31FN2O4S MolecularWeight: 510.620143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(C(C1C2=NC=CS2)(C3=CC=CC=C3)C(=O)OCC)C)C.C1=CC=C(C=C1)F

Isomeric SMILES

CCOC(=O)C1=C(NC(C(C1C2=NC=CS2)(C3=CC=CC=C3)C(=O)OCC)C)C.C1=CC=C(C=C1)F

InChI

InChI=1S/C22H26N2O4S.C6H5F/c1-5-27-20(25)17-14(3)24-15(4)22(21(26)28-6-2,16-10-8-7-9-11-16)18(17)19-23-12-13-29-19;7-6-4-2-1-3-5-6/h7-13,15,18,24H,5-6H2,1-4H3;1-5H