N-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]furan-2-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]furan-2-carboxamide Openeye Name: N-[2-oxo-2-[4-(3-thienylmethyl)-1,4-diazepan-1-yl]ethyl]furan-2-carboxamide CAS Name: N-[2-oxo-2-[4-(3-thiophenylmethyl)-1,4-diazepan-1-yl]ethyl]-2-furancarboxamide IUPAC Name: N-[2-oxo-2-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]ethyl]furan-2-carboxamide Traditional Name: N-[2-keto-2-[4-(3-thenyl)-1,4-diazepan-1-yl]ethyl]-2-furamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CNC(=O)C2=CC=CO2)CC3=CSC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)CNC(=O)C2=CC=CO2)CC3=CSC=C3

InChI

InChI=1S/C17H21N3O3S/c21-16(11-18-17(22)15-3-1-9-23-15)20-6-2-5-19(7-8-20)12-14-4-10-24-13-14/h1,3-4,9-10,13H,2,5-8,11-12H2,(H,18,22)