N-[(4-chlorophenyl)methyl]-3-(dimethylamino)-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-5-prop-1-ynyl-2H-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-3-(dimethylamino)-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-5-prop-1-ynyl-2H-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-3-(dimethylamino)-1-methyl-6-(morpholinomethyl)-4-oxo-5-prop-1-ynyl-2H-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-3-(dimethylamino)-1-methyl-6-(4-morpholinylmethyl)-4-oxo-5-prop-1-ynyl-2H-cinnoline-3-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-3-(dimethylamino)-1-methyl-6-(morpholin-4-ylmethyl)-4-oxo-5-prop-1-ynyl-2H-cinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-3-(dimethylamino)-4-keto-1-methyl-6-(morpholinomethyl)-5-prop-1-ynyl-2H-cinnoline-3-carboxamide Formula: C27H32ClN5O3 MolecularWeight: 510.02768

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=C(C=CC2=C1C(=O)C(NN2C)(C(=O)NCC3=CC=C(C=C3)Cl)N(C)C)CN4CCOCC4

Isomeric SMILES

CC#CC1=C(C=CC2=C1C(=O)C(NN2C)(C(=O)NCC3=CC=C(C=C3)Cl)N(C)C)CN4CCOCC4

InChI

InChI=1S/C27H32ClN5O3/c1-5-6-22-20(18-33-13-15-36-16-14-33)9-12-23-24(22)25(34)27(31(2)3,30-32(23)4)26(35)29-17-19-7-10-21(28)11-8-19/h7-12,30H,13-18H2,1-4H3,(H,29,35)