4-(8-oxidanyl-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)butanenitrile

Systemtic Name: 4-(8-oxidanyl-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)butanenitrile Openeye Name: 4-(8-hydroxy-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)butanenitrile CAS Name: 4-(8-hydroxy-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)butanenitrile IUPAC Name: 4-(8-hydroxy-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)butanenitrile Traditional Name: 4-(8-hydroxy-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-3-yl)butyronitrile Formula: C10H13N5O MolecularWeight: 219.24312

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(NC=N1)N(C=N2)CCCC#N)O

Isomeric SMILES

C1C(C2=C(NC=N1)N(C=N2)CCCC#N)O

InChI

InChI=1S/C10H13N5O/c11-3-1-2-4-15-7-14-9-8(16)5-12-6-13-10(9)15/h6-8,16H,1-2,4-5H2,(H,12,13)