diethyl 2-(2-azanylethylselanylmethyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-(2-azanylethylselanylmethyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-(2-aminoethylselanylmethyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[(2-aminoethylseleno)methyl]-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(2-aminoethylselanylmethyl)-6-methyl-4-(3-methylsulfanylphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(2-aminoethylseleno)methyl]-6-methyl-4-[3-(methylthio)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C22H30N2O4SSe MolecularWeight: 497.5096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)SC)C(=O)OCC)C[Se]CCN)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)SC)C(=O)OCC)C[Se]CCN)C

InChI

InChI=1S/C22H30N2O4SSe/c1-5-27-21(25)18-14(3)24-17(13-30-11-10-23)20(22(26)28-6-2)19(18)15-8-7-9-16(12-15)29-4/h7-9,12,19,24H,5-6,10-11,13,23H2,1-4H3