2-(3,4-dimethoxyphenyl)-5-[2-(3-ethyl-1-methyl-indazol-6-yl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3-ethyl-1-methyl-indazol-6-yl)ethyl-methyl-amino]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3-ethyl-1-methyl-indazol-6-yl)ethyl-methyl-amino]-2-isopropyl-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3-ethyl-1-methyl-6-indazolyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3-ethyl-1-methylindazol-6-yl)ethyl-methylamino]-2-propan-2-ylpentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3-ethyl-1-methyl-indazol-6-yl)ethyl-methyl-amino]-2-isopropyl-valeronitrile Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)CCN(C)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)CCN(C)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C

InChI

InChI=1S/C29H40N4O2/c1-8-25-24-12-10-22(18-26(24)33(5)31-25)14-17-32(4)16-9-15-29(20-30,21(2)3)23-11-13-27(34-6)28(19-23)35-7/h10-13,18-19,21H,8-9,14-17H2,1-7H3