N'-[3-[2,6-bis(chloranyl)-4-ethoxy-phenyl]-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]-N-[1-(phenylmethyl)piperidin-4-yl]ethane-1,2-diamine

Systemtic Name: N'-[3-[2,6-bis(chloranyl)-4-ethoxy-phenyl]-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]-N-[1-(phenylmethyl)piperidin-4-yl]ethane-1,2-diamine Openeye Name: N-(1-benzyl-4-piperidyl)-N'-[3-(2,6-dichloro-4-ethoxy-phenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine CAS Name: N'-[3-(2,6-dichloro-4-ethoxyphenyl)-2,5-dimethyl-7-pyrazolo[1,5-a]pyrimidinyl]-N-[1-(phenylmethyl)-4-piperidinyl]ethane-1,2-diamine IUPAC Name: N-(1-benzylpiperidin-4-yl)-N'-[3-(2,6-dichloro-4-ethoxyphenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine Traditional Name: (1-benzyl-4-piperidyl)-[2-[[3-(2,6-dichloro-4-ethoxy-phenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]amino]ethyl]amine Formula: C30H36Cl2N6O MolecularWeight: 567.55244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C(=C1)Cl)C2=C3N=C(C=C(N3N=C2C)NCCNC4CCN(CC4)CC5=CC=CC=C5)C)Cl

Isomeric SMILES

CCOC1=CC(=C(C(=C1)Cl)C2=C3N=C(C=C(N3N=C2C)NCCNC4CCN(CC4)CC5=CC=CC=C5)C)Cl

InChI

InChI=1S/C30H36Cl2N6O/c1-4-39-24-17-25(31)29(26(32)18-24)28-21(3)36-38-27(16-20(2)35-30(28)38)34-13-12-33-23-10-14-37(15-11-23)19-22-8-6-5-7-9-22/h5-9,16-18,23,33-34H,4,10-15,19H2,1-3H3