3-[2-cyanoethyl-[4-[[8-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]-3,8-diazaspiro[4.5]decan-3-yl]methyl]phenyl]amino]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-[4-[[8-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]-3,8-diazaspiro[4.5]decan-3-yl]methyl]phenyl]amino]propanenitrile Openeye Name: 3-[N-(2-cyanoethyl)-4-[[8-(3,5-dimethylisoxazole-4-carbonyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]anilino]propanenitrile CAS Name: 3-[N-(2-cyanoethyl)-4-[[8-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-3,8-diazaspiro[4.5]decan-3-yl]methyl]anilino]propanenitrile IUPAC Name: 3-[N-(2-cyanoethyl)-4-[[8-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]anilino]propanenitrile Traditional Name: 3-[N-(2-cyanoethyl)-4-[[8-(3,5-dimethylisoxazole-4-carbonyl)-3,8-diazaspiro[4.5]decan-3-yl]methyl]anilino]propionitrile Formula: C27H34N6O2 MolecularWeight: 474.59786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)CCN(C3)CC4=CC=C(C=C4)N(CCC#N)CCC#N

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)CCN(C3)CC4=CC=C(C=C4)N(CCC#N)CCC#N

InChI

InChI=1S/C27H34N6O2/c1-21-25(22(2)35-30-21)26(34)33-17-10-27(11-18-33)9-16-31(20-27)19-23-5-7-24(8-6-23)32(14-3-12-28)15-4-13-29/h5-8H,3-4,9-11,14-20H2,1-2H3