2-[4-(3-bromanylthiophen-2-yl)carbonyl-1,4-diazepan-1-yl]-N-(2-chlorophenyl)ethanamide

Systemtic Name: 2-[4-(3-bromanylthiophen-2-yl)carbonyl-1,4-diazepan-1-yl]-N-(2-chlorophenyl)ethanamide Openeye Name: 2-[4-(3-bromothiophene-2-carbonyl)-1,4-diazepan-1-yl]-N-(2-chlorophenyl)acetamide CAS Name: 2-[4-[(3-bromo-2-thiophenyl)-oxomethyl]-1,4-diazepan-1-yl]-N-(2-chlorophenyl)acetamide IUPAC Name: 2-[4-(3-bromothiophene-2-carbonyl)-1,4-diazepan-1-yl]-N-(2-chlorophenyl)acetamide Traditional Name: 2-[4-(3-bromothiophene-2-carbonyl)-1,4-diazepan-1-yl]-N-(2-chlorophenyl)acetamide Formula: C18H19BrClN3O2S MolecularWeight: 456.78436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=C(C=CS2)Br)CC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=C(C=CS2)Br)CC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C18H19BrClN3O2S/c19-13-6-11-26-17(13)18(25)23-8-3-7-22(9-10-23)12-16(24)21-15-5-2-1-4-14(15)20/h1-2,4-6,11H,3,7-10,12H2,(H,21,24)