dimethyl 2-[(2-chloroethylamino)methyl]-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2-[(2-chloroethylamino)methyl]-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2-[(2-chloroethylamino)methyl]-6-methyl-4-(2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[(2-chloroethylamino)methyl]-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-chloroethylamino)methyl]-6-methyl-4-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(2-chloroethylamino)methyl]-6-methyl-4-(2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C17H21ClN2O4S MolecularWeight: 384.87764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CNCCCl)C(=O)OC)C2=CC=CS2)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)CNCCCl)C(=O)OC)C2=CC=CS2)C(=O)OC

InChI

InChI=1S/C17H21ClN2O4S/c1-10-13(16(21)23-2)15(12-5-4-8-25-12)14(17(22)24-3)11(20-10)9-19-7-6-18/h4-5,8,15,19-20H,6-7,9H2,1-3H3