2-azanyl-1-[2-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]ethyl]-4,5-dimethyl-pyrrole-3-carbonitrile

Systemtic Name: 2-azanyl-1-[2-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]ethyl]-4,5-dimethyl-pyrrole-3-carbonitrile Openeye Name: 2-amino-1-[2-[4-(5-chloro-2-methoxy-benzoyl)piperazin-1-yl]ethyl]-4,5-dimethyl-pyrrole-3-carbonitrile CAS Name: 2-amino-1-[2-[4-[(5-chloro-2-methoxyphenyl)-oxomethyl]-1-piperazinyl]ethyl]-4,5-dimethyl-3-pyrrolecarbonitrile IUPAC Name: 2-amino-1-[2-[4-(5-chloro-2-methoxybenzoyl)piperazin-1-yl]ethyl]-4,5-dimethylpyrrole-3-carbonitrile Traditional Name: 2-amino-1-[2-[4-(5-chloro-2-methoxy-benzoyl)piperazino]ethyl]-4,5-dimethyl-pyrrole-3-carbonitrile Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)N)CCN2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)OC)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)N)CCN2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)OC)C

InChI

InChI=1S/C21H26ClN5O2/c1-14-15(2)27(20(24)18(14)13-23)11-8-25-6-9-26(10-7-25)21(28)17-12-16(22)4-5-19(17)29-3/h4-5,12H,6-11,24H2,1-3H3