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

Systemtic Name: (2S)-N-cyano-N'-cyclopropyl-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboximidamide Openeye Name: (2S)-N-cyano-N'-cyclopropyl-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamidine CAS Name: (2S)-N-cyano-N'-cyclopropyl-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-piperazinecarboximidamide IUPAC Name: (2S)-N-cyano-N'-cyclopropyl-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboximidamide Traditional Name: (2S)-N-cyano-N'-cyclopropyl-2-methyl-4-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamidine Formula: C17H22N8 MolecularWeight: 338.41018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=NC2CC2)NC#N)C3=NC=NC4=C3C(=CN4)C

Isomeric SMILES

C[C@H]1CN(CCN1C(=NC2CC2)NC#N)C3=NC=NC4=C3C(=CN4)C

InChI

InChI=1S/C17H22N8/c1-11-7-19-15-14(11)16(22-10-21-15)24-5-6-25(12(2)8-24)17(20-9-18)23-13-3-4-13/h7,10,12-13H,3-6,8H2,1-2H3,(H,20,23)(H,19,21,22)/t12-/m0/s1