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

Systemtic Name: (3-ethoxythiophen-2-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (3-ethoxy-2-thienyl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-ethoxy-2-thiophenyl)-[4-(2-thiazolylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (3-ethoxythiophen-2-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (3-ethoxy-2-thienyl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(SC=C1)C(=O)N2CCCN(CC2)CC3=NC=CS3

Isomeric SMILES

CCOC1=C(SC=C1)C(=O)N2CCCN(CC2)CC3=NC=CS3

InChI

InChI=1S/C16H21N3O2S2/c1-2-21-13-4-10-23-15(13)16(20)19-7-3-6-18(8-9-19)12-14-17-5-11-22-14/h4-5,10-11H,2-3,6-9,12H2,1H3