N-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-keto-2-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]ethyl]thiophene-2-carboxamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=CS3

Isomeric SMILES

CN1C=CN=C1CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C17H23N5O2S/c1-20-8-5-18-15(20)13-21-6-3-7-22(10-9-21)16(23)12-19-17(24)14-4-2-11-25-14/h2,4-5,8,11H,3,6-7,9-10,12-13H2,1H3,(H,19,24)