1-[methyl(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea

Systemtic Name: 1-[methyl(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Openeye Name: 1-[methyl(3-phenylpropanoyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea CAS Name: 1-[methyl-(1-oxo-3-phenylpropyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea IUPAC Name: 1-[methyl(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Traditional Name: 1-[hydrocinnamoyl(methyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea Formula: C13H15N5O2S2 MolecularWeight: 337.4205

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CCC1=CC=CC=C1)NC(=O)NC2=NNC(=S)S2

Isomeric SMILES

CN(C(=O)CCC1=CC=CC=C1)NC(=O)NC2=NNC(=S)S2

InChI

InChI=1S/C13H15N5O2S2/c1-18(10(19)8-7-9-5-3-2-4-6-9)17-11(20)14-12-15-16-13(21)22-12/h2-6H,7-8H2,1H3,(H,16,21)(H2,14,15,17,20)