(2S)-N-cyano-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N'-pyridin-3-yl-piperazine-1-carboximidamide

Systemtic Name: (2S)-N-cyano-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N'-pyridin-3-yl-piperazine-1-carboximidamide Openeye Name: (2S)-N-cyano-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N'-(3-pyridyl)piperazine-1-carboxamidine CAS Name: (2S)-N-cyano-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N'-(3-pyridinyl)-1-piperazinecarboximidamide IUPAC Name: (2S)-N-cyano-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N'-pyridin-3-ylpiperazine-1-carboximidamide Traditional Name: (2S)-N-cyano-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N'-(3-pyridyl)piperazine-1-carboxamidine Formula: C19H21N9 MolecularWeight: 375.43034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=NC2=CN=CC=C2)NC#N)C3=NC=NC4=C3C(=CN4)C

Isomeric SMILES

C[C@H]1CN(CCN1C(=NC2=CN=CC=C2)NC#N)C3=NC=NC4=C3C(=CN4)C

InChI

InChI=1S/C19H21N9/c1-13-8-22-17-16(13)18(25-12-24-17)27-6-7-28(14(2)10-27)19(23-11-20)26-15-4-3-5-21-9-15/h3-5,8-9,12,14H,6-7,10H2,1-2H3,(H,23,26)(H,22,24,25)/t14-/m0/s1