1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)urea

Systemtic Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-[5-(propylthio)-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-[5-(propylthio)-1,3,4-thiadiazol-2-yl]urea Formula: C18H24N4OS2 MolecularWeight: 376.53936

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C

InChI

InChI=1S/C18H24N4OS2/c1-6-10-24-17-22-21-16(25-17)19-15(23)20-18(4,5)14-9-7-8-13(11-14)12(2)3/h7-9,11H,2,6,10H2,1,3-5H3,(H2,19,20,21,23)