O3-ethyl O5-methyl 4-(2-chlorophenyl)-2-[2-[[N-cyano-N'-(2-dimethylaminoethyl)carbamimidoyl]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-methyl 4-(2-chlorophenyl)-2-[2-[[N-cyano-N'-(2-dimethylaminoethyl)carbamimidoyl]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 4-(2-chlorophenyl)-2-[2-[[N-cyano-N'-(2-dimethylaminoethyl)carbamimidoyl]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chlorophenyl)-2-[2-[[(cyanoamino)-(2-dimethylaminoethylimino)methyl]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl 4-(2-chlorophenyl)-2-[2-[[N-cyano-N'-(2-dimethylaminoethyl)carbamimidoyl]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chlorophenyl)-2-[2-[[N-cyano-N'-(2-dimethylaminoethyl)amidino]amino]ethoxymethyl]-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C26H35ClN6O5 MolecularWeight: 547.0463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=NCCN(C)C)NC#N

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OC)C)COCCNC(=NCCN(C)C)NC#N

InChI

InChI=1S/C26H35ClN6O5/c1-6-38-25(35)23-20(15-37-14-12-30-26(31-16-28)29-11-13-33(3)4)32-17(2)21(24(34)36-5)22(23)18-9-7-8-10-19(18)27/h7-10,22,32H,6,11-15H2,1-5H3,(H2,29,30,31)