(3-bromanylthiophen-2-yl)-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-bromanylthiophen-2-yl)-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-bromo-2-thienyl)-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: (3-bromo-2-thiophenyl)-[4-[(5-methyl-3-isoxazolyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3-bromothiophen-2-yl)-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3-bromo-2-thienyl)-[4-[(5-methylisoxazol-3-yl)methyl]-1,4-diazepan-1-yl]methanone Formula: C15H18BrN3O2S MolecularWeight: 384.29132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN2CCCN(CC2)C(=O)C3=C(C=CS3)Br

Isomeric SMILES

CC1=CC(=NO1)CN2CCCN(CC2)C(=O)C3=C(C=CS3)Br

InChI

InChI=1S/C15H18BrN3O2S/c1-11-9-12(17-21-11)10-18-4-2-5-19(7-6-18)15(20)14-13(16)3-8-22-14/h3,8-9H,2,4-7,10H2,1H3