5-[(3-methylphenyl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-methylphenyl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-(m-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-methylphenyl)methylthio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-methylphenyl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[(3-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C13H15N3S2 MolecularWeight: 277.4083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(S2)NCC=C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(S2)NCC=C

InChI

InChI=1S/C13H15N3S2/c1-3-7-14-12-15-16-13(18-12)17-9-11-6-4-5-10(2)8-11/h3-6,8H,1,7,9H2,2H3,(H,14,15)