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

Systemtic Name: 1-[3-phenylpropanoyl(propan-2-yl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Openeye Name: 1-[isopropyl(3-phenylpropanoyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea CAS Name: 1-[(1-oxo-3-phenylpropyl)-propan-2-ylamino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea IUPAC Name: 1-[3-phenylpropanoyl(propan-2-yl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Traditional Name: 1-[hydrocinnamoyl(isopropyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea Formula: C15H19N5O2S2 MolecularWeight: 365.47366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N5O2S2/c1-10(2)20(12(21)9-8-11-6-4-3-5-7-11)19-13(22)16-14-17-18-15(23)24-14/h3-7,10H,8-9H2,1-2H3,(H,18,23)(H2,16,17,19,22)