N-(phenylmethyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanamide

Systemtic Name: N-(phenylmethyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanamide Openeye Name: N-benzyl-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]butanamide CAS Name: N-(phenylmethyl)-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]butanamide IUPAC Name: N-benzyl-2-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanamide Traditional Name: N-benzyl-2-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]butyramide Formula: C19H22N4OS3 MolecularWeight: 418.59918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(S2)NCCC3=CC=CS3

Isomeric SMILES

CCC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(S2)NCCC3=CC=CS3

InChI

InChI=1S/C19H22N4OS3/c1-2-16(17(24)21-13-14-7-4-3-5-8-14)26-19-23-22-18(27-19)20-11-10-15-9-6-12-25-15/h3-9,12,16H,2,10-11,13H2,1H3,(H,20,22)(H,21,24)