N-phenethyl-4-(2-thiophen-2-ylethanoyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-phenethyl-4-(2-thiophen-2-ylethanoyl)-1,4-diazepane-1-carboxamide Openeye Name: N-phenethyl-4-[2-(2-thienyl)acetyl]-1,4-diazepane-1-carboxamide CAS Name: 4-(1-oxo-2-thiophen-2-ylethyl)-N-phenethyl-1,4-diazepane-1-carboxamide IUPAC Name: N-phenethyl-4-(2-thiophen-2-ylacetyl)-1,4-diazepane-1-carboxamide Traditional Name: N-phenethyl-4-[2-(2-thienyl)acetyl]-1,4-diazepane-1-carboxamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCCC2=CC=CC=C2)C(=O)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCCC2=CC=CC=C2)C(=O)CC3=CC=CS3

InChI

InChI=1S/C20H25N3O2S/c24-19(16-18-8-4-15-26-18)22-11-5-12-23(14-13-22)20(25)21-10-9-17-6-2-1-3-7-17/h1-4,6-8,15H,5,9-14,16H2,(H,21,25)