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

Systemtic Name: 1-[phenethyl(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Openeye Name: 1-[phenethyl(3-phenylpropanoyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea CAS Name: 1-[(1-oxo-3-phenylpropyl)-phenethylamino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea IUPAC Name: 1-[phenethyl(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Traditional Name: 1-[hydrocinnamoyl(phenethyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N(CCC2=CC=CC=C2)NC(=O)NC3=NNC(=S)S3

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N(CCC2=CC=CC=C2)NC(=O)NC3=NNC(=S)S3

InChI

InChI=1S/C20H21N5O2S2/c26-17(12-11-15-7-3-1-4-8-15)25(14-13-16-9-5-2-6-10-16)24-18(27)21-19-22-23-20(28)29-19/h1-10H,11-14H2,(H,23,28)(H2,21,22,24,27)