(4-bromanyl-1H-pyrrol-2-yl)-(1,4-thiazepan-4-yl)methanone

Systemtic Name: (4-bromanyl-1H-pyrrol-2-yl)-(1,4-thiazepan-4-yl)methanone Openeye Name: (4-bromo-1H-pyrrol-2-yl)-(1,4-thiazepan-4-yl)methanone CAS Name: (4-bromo-1H-pyrrol-2-yl)-(1,4-thiazepan-4-yl)methanone IUPAC Name: (4-bromo-1H-pyrrol-2-yl)-(1,4-thiazepan-4-yl)methanone Traditional Name: (4-bromo-1H-pyrrol-2-yl)-(1,4-thiazepan-4-yl)methanone Formula: C10H13BrN2OS MolecularWeight: 289.19202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCSC1)C(=O)C2=CC(=CN2)Br

Isomeric SMILES

C1CN(CCSC1)C(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C10H13BrN2OS/c11-8-6-9(12-7-8)10(14)13-2-1-4-15-5-3-13/h6-7,12H,1-5H2