N-(2-bromanyl-4-methyl-phenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]propionamide Formula: C18H19BrN4OS3 MolecularWeight: 483.46866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)NCCC3=CC=CS3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)NCCC3=CC=CS3)Br

InChI

InChI=1S/C18H19BrN4OS3/c1-11-5-6-15(14(19)10-11)21-16(24)12(2)26-18-23-22-17(27-18)20-8-7-13-4-3-9-25-13/h3-6,9-10,12H,7-8H2,1-2H3,(H,20,22)(H,21,24)