2-[[5-[(3-chloranyl-4-methyl-phenyl)amino]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-amino]-N-propyl-ethanamide

Systemtic Name: 2-[[5-[(3-chloranyl-4-methyl-phenyl)amino]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-amino]-N-propyl-ethanamide Openeye Name: 2-[[5-(3-chloro-4-methyl-anilino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl-methyl-amino]-N-propyl-acetamide CAS Name: 2-[[5-(3-chloro-4-methylanilino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methylamino]-N-propylacetamide IUPAC Name: 2-[[5-(3-chloro-4-methylanilino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methylamino]-N-propylacetamide Traditional Name: 2-[[5-(3-chloro-4-methyl-anilino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl-methyl-amino]-N-propyl-acetamide Formula: C16H22ClN5OS2 MolecularWeight: 399.96178

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CN1C(=S)SC(=N1)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCNC(=O)CN(C)CN1C(=S)SC(=N1)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C16H22ClN5OS2/c1-4-7-18-14(23)9-21(3)10-22-16(24)25-15(20-22)19-12-6-5-11(2)13(17)8-12/h5-6,8H,4,7,9-10H2,1-3H3,(H,18,23)(H,19,20)