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

Systemtic Name: N'-(3-bromophenyl)-N-cyano-2-methyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboximidamide Openeye Name: N'-(3-bromophenyl)-N-cyano-2-methyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamidine CAS Name: N'-(3-bromophenyl)-N-cyano-2-methyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-piperazinecarboximidamide IUPAC Name: N'-(3-bromophenyl)-N-cyano-2-methyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboximidamide Traditional Name: N'-(3-bromophenyl)-N-cyano-2-methyl-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamidine Formula: C19H19BrN8 MolecularWeight: 439.31176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN8/c1-13-10-27(18-16-5-6-22-17(16)24-12-25-18)7-8-28(13)19(23-11-21)26-15-4-2-3-14(20)9-15/h2-6,9,12-13H,7-8,10H2,1H3,(H,23,26)(H,22,24,25)