N-(pyridin-2-ylmethyl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(pyridin-2-ylmethyl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-(2-pyridylmethyl)-4-(2-thienylmethyl)-1,4-diazepane-1-carboxamide CAS Name: N-(2-pyridinylmethyl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(pyridin-2-ylmethyl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2-pyridylmethyl)-4-(2-thenyl)-1,4-diazepane-1-carboxamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCC2=CC=CC=N2)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCC2=CC=CC=N2)CC3=CC=CS3

InChI

InChI=1S/C17H22N4OS/c22-17(19-13-15-5-1-2-7-18-15)21-9-4-8-20(10-11-21)14-16-6-3-12-23-16/h1-3,5-7,12H,4,8-11,13-14H2,(H,19,22)