4-(5-azanyl-4-oxidanylidene-pyrazol-3-yl)-2-bromanyl-4,5,6,7-tetrahydro-3aH-pyrrolo[2,3-c]azepin-8-one

Systemtic Name: 4-(5-azanyl-4-oxidanylidene-pyrazol-3-yl)-2-bromanyl-4,5,6,7-tetrahydro-3aH-pyrrolo[2,3-c]azepin-8-one Openeye Name: 4-(5-amino-4-oxo-pyrazol-3-yl)-2-bromo-4,5,6,7-tetrahydro-3aH-pyrrolo[2,3-c]azepin-8-one CAS Name: 4-(5-amino-4-oxo-3-pyrazolyl)-2-bromo-4,5,6,7-tetrahydro-3aH-pyrrolo[2,3-c]azepin-8-one IUPAC Name: 4-(5-amino-4-oxopyrazol-3-yl)-2-bromo-4,5,6,7-tetrahydro-3aH-pyrrolo[2,3-c]azepin-8-one Traditional Name: 4-(5-amino-4-keto-pyrazol-3-yl)-2-bromo-4,5,6,7-tetrahydro-3aH-pyrrol[2,3-c]azepin-8-one Formula: C11H10BrN5O2 MolecularWeight: 324.1334

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=NC(=CC2C1C3=NN=C(C3=O)N)Br

Isomeric SMILES

C1CNC(=O)C2=NC(=CC2C1C3=NN=C(C3=O)N)Br

InChI

InChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-9(18)10(13)17-16-7)1-2-14-11(19)8(5)15-6/h3-5H,1-2H2,(H,14,19)(H2,13,17,18)