N-phenethyl-2-[4-[(2-sulfanylidene-1,3-thiazolidin-4-yl)carbonyl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-phenethyl-2-[4-[(2-sulfanylidene-1,3-thiazolidin-4-yl)carbonyl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-phenethyl-2-[4-(2-thioxothiazolidine-4-carbonyl)-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-[oxo-(2-sulfanylidene-4-thiazolidinyl)methyl]-1,4-diazepan-1-yl]-N-phenethylacetamide IUPAC Name: N-phenethyl-2-[4-(2-sulfanylidene-1,3-thiazolidine-4-carbonyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-phenethyl-2-[4-(2-thioxothiazolidine-4-carbonyl)-1,4-diazepan-1-yl]acetamide Formula: C19H26N4O2S2 MolecularWeight: 406.56534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CSC(=S)N2)CC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CSC(=S)N2)CC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O2S2/c24-17(20-8-7-15-5-2-1-3-6-15)13-22-9-4-10-23(12-11-22)18(25)16-14-27-19(26)21-16/h1-3,5-6,16H,4,7-14H2,(H,20,24)(H,21,26)