N-(2-morpholin-4-ylethyl)-4-(1,3-thiazol-2-ylmethyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-4-(1,3-thiazol-2-ylmethyl)-1,4-diazepane-1-carbothioamide Openeye Name: N-(2-morpholinoethyl)-4-(thiazol-2-ylmethyl)-1,4-diazepane-1-carbothioamide CAS Name: N-[2-(4-morpholinyl)ethyl]-4-(2-thiazolylmethyl)-1,4-diazepane-1-carbothioamide IUPAC Name: N-(2-morpholin-4-ylethyl)-4-(1,3-thiazol-2-ylmethyl)-1,4-diazepane-1-carbothioamide Traditional Name: N-(2-morpholinoethyl)-4-(thiazol-2-ylmethyl)-1,4-diazepane-1-carbothioamide Formula: C16H27N5OS2 MolecularWeight: 369.54848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=S)NCCN2CCOCC2)CC3=NC=CS3

Isomeric SMILES

C1CN(CCN(C1)C(=S)NCCN2CCOCC2)CC3=NC=CS3

InChI

InChI=1S/C16H27N5OS2/c23-16(18-2-6-19-9-11-22-12-10-19)21-5-1-4-20(7-8-21)14-15-17-3-13-24-15/h3,13H,1-2,4-12,14H2,(H,18,23)