(3-ethoxythiophen-2-yl)-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-ethoxythiophen-2-yl)-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (3-ethoxy-2-thienyl)-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-ethoxy-2-thiophenyl)-[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (3-ethoxythiophen-2-yl)-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (3-ethoxy-2-thienyl)-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methanone Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC=C1)C(=O)N2CCCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

CCOC1=C(SC=C1)C(=O)N2CCCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C18H23N3O2S/c1-2-23-16-6-12-24-17(16)18(22)21-9-4-8-20(10-11-21)14-15-5-3-7-19-13-15/h3,5-7,12-13H,2,4,8-11,14H2,1H3