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

Systemtic Name: 1-[(phenylmethyl)-(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Openeye Name: 1-[benzyl(3-phenylpropanoyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea CAS Name: 1-[(1-oxo-3-phenylpropyl)-(phenylmethyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea IUPAC Name: 1-[benzyl(3-phenylpropanoyl)amino]-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)urea Traditional Name: 1-[benzyl(hydrocinnamoyl)amino]-3-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)urea Formula: C19H19N5O2S2 MolecularWeight: 413.51646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)N(CC2=CC=CC=C2)NC(=O)NC3=NNC(=S)S3

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)N(CC2=CC=CC=C2)NC(=O)NC3=NNC(=S)S3

InChI

InChI=1S/C19H19N5O2S2/c25-16(12-11-14-7-3-1-4-8-14)24(13-15-9-5-2-6-10-15)23-17(26)20-18-21-22-19(27)28-18/h1-10H,11-13H2,(H,22,27)(H2,20,21,23,26)