cyclohexyl-[(3R)-3-methyl-4-(1-phenylpyrido[3,4-d]pyridazin-4-yl)piperazin-1-yl]methanone

Systemtic Name: cyclohexyl-[(3R)-3-methyl-4-(1-phenylpyrido[3,4-d]pyridazin-4-yl)piperazin-1-yl]methanone Openeye Name: cyclohexyl-[(3R)-3-methyl-4-(1-phenylpyrido[3,4-d]pyridazin-4-yl)piperazin-1-yl]methanone CAS Name: cyclohexyl-[(3R)-3-methyl-4-(1-phenyl-4-pyrido[3,4-d]pyridazinyl)-1-piperazinyl]methanone IUPAC Name: cyclohexyl-[(3R)-3-methyl-4-(1-phenylpyrido[3,4-d]pyridazin-4-yl)piperazin-1-yl]methanone Traditional Name: cyclohexyl-[(3R)-3-methyl-4-(1-phenylpyrido[3,4-d]pyridazin-4-yl)piperazino]methanone Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NN=C(C3=C2C=NC=C3)C4=CC=CC=C4)C(=O)C5CCCCC5

Isomeric SMILES

C[C@@H]1CN(CCN1C2=NN=C(C3=C2C=NC=C3)C4=CC=CC=C4)C(=O)C5CCCCC5

InChI

InChI=1S/C25H29N5O/c1-18-17-29(25(31)20-10-6-3-7-11-20)14-15-30(18)24-22-16-26-13-12-21(22)23(27-28-24)19-8-4-2-5-9-19/h2,4-5,8-9,12-13,16,18,20H,3,6-7,10-11,14-15,17H2,1H3/t18-/m1/s1