N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-yl]ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazinyl]ethyl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-yl]ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-[4-(m-tolyl)piperazino]ethyl]-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCNC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C26H31N5O3/c1-21-6-5-7-22(20-21)30-16-14-29(15-17-30)13-12-27-26(33)24-10-11-25(32)31(28-24)18-19-34-23-8-3-2-4-9-23/h2-11,20H,12-19H2,1H3,(H,27,33)