N-(6-methoxypyridin-3-yl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(6-methoxypyridin-3-yl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-(6-methoxy-3-pyridyl)-4-(2-thienylmethyl)-1,4-diazepane-1-carboxamide CAS Name: N-(6-methoxy-3-pyridinyl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(6-methoxypyridin-3-yl)-4-(thiophen-2-ylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(6-methoxy-3-pyridyl)-4-(2-thenyl)-1,4-diazepane-1-carboxamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)NC(=O)N2CCCN(CC2)CC3=CC=CS3

Isomeric SMILES

COC1=NC=C(C=C1)NC(=O)N2CCCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C17H22N4O2S/c1-23-16-6-5-14(12-18-16)19-17(22)21-8-3-7-20(9-10-21)13-15-4-2-11-24-15/h2,4-6,11-12H,3,7-10,13H2,1H3,(H,19,22)