N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-(1,4-diazepan-1-ylcarbonyl)phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-(1,4-diazepane-1-carbonyl)phenyl]thiophene-2-carboxamide Formula: C17H18ClN3O2S MolecularWeight: 363.86172

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C17H18ClN3O2S/c18-13-5-4-12(17(23)21-8-2-6-19-7-9-21)11-14(13)20-16(22)15-3-1-10-24-15/h1,3-5,10-11,19H,2,6-9H2,(H,20,22)