4-[2-oxidanylidene-2-(phenethylamino)ethyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2-oxidanylidene-2-(phenethylamino)ethyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[2-oxo-2-(phenethylamino)ethyl]-N-[2-(2-thienyl)ethyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[2-oxo-2-(phenethylamino)ethyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[2-oxo-2-(phenethylamino)ethyl]-N-(2-thiophen-2-ylethyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[2-keto-2-(phenethylamino)ethyl]-N-[2-(2-thienyl)ethyl]-1,4-diazepane-1-carboxamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCCC2=CC=CS2)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCCC2=CC=CS2)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H30N4O2S/c27-21(23-11-9-19-6-2-1-3-7-19)18-25-13-5-14-26(16-15-25)22(28)24-12-10-20-8-4-17-29-20/h1-4,6-8,17H,5,9-16,18H2,(H,23,27)(H,24,28)