3-(phenylmethyl)-1-prop-2-enyl-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea

Systemtic Name: 3-(phenylmethyl)-1-prop-2-enyl-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Openeye Name: 1-allyl-3-benzyl-1-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea CAS Name: 3-(phenylmethyl)-1-prop-2-enyl-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea IUPAC Name: 3-benzyl-1-prop-2-enyl-1-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Traditional Name: 1-allyl-3-benzyl-1-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea Formula: C13H14N4OS2 MolecularWeight: 306.40646

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=NNC(=S)S1)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

C=CCN(C1=NNC(=S)S1)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C13H14N4OS2/c1-2-8-17(12-15-16-13(19)20-12)11(18)14-9-10-6-4-3-5-7-10/h2-7H,1,8-9H2,(H,14,18)(H,16,19)