5-(phenylmethyl)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(phenylmethyl)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-benzyl-1,3,4-thiadiazol-2-amine CAS Name: 5-(phenylmethyl)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-benzyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-(5-benzyl-1,3,4-thiadiazol-2-yl)amine Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)CC2=CC=CC=C2

Isomeric SMILES

C=CCNC1=NN=C(S1)CC2=CC=CC=C2

InChI

InChI=1S/C12H13N3S/c1-2-8-13-12-15-14-11(16-12)9-10-6-4-3-5-7-10/h2-7H,1,8-9H2,(H,13,15)