N-[3-[[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[[2-(2-oxoazepan-1-yl)acetyl]amino]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[oxo-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]hydrazo]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[[2-(2-oxoazepan-1-yl)acetyl]amino]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[[2-(2-ketoazepan-1-yl)acetyl]amino]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N4O4S/c25-17(13-24-10-3-1-2-9-18(24)26)22-23-19(27)14-6-4-7-15(12-14)21-20(28)16-8-5-11-29-16/h4-8,11-12H,1-3,9-10,13H2,(H,21,28)(H,22,25)(H,23,27)