4-azanyl-N-[5-[(4-methylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 4-azanyl-N-[5-[(4-methylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 4-amino-N-[5-(p-tolylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 4-amino-N-[5-[[(4-methylphenyl)thio]methyl]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-amino-N-[5-[(4-methylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 4-amino-N-[5-[(p-tolylthio)methyl]-1,3,4-thiadiazol-2-yl]butyramide Formula: C14H18N4OS2 MolecularWeight: 322.44892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)CCCN

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NN=C(S2)NC(=O)CCCN

InChI

InChI=1S/C14H18N4OS2/c1-10-4-6-11(7-5-10)20-9-13-17-18-14(21-13)16-12(19)3-2-8-15/h4-7H,2-3,8-9,15H2,1H3,(H,16,18,19)