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

Systemtic Name: 1-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea CAS Name: 1-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]urea IUPAC Name: 1-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea Formula: C19H26N4OS2 MolecularWeight: 390.56594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C

InChI

InChI=1S/C19H26N4OS2/c1-6-7-11-25-18-23-22-17(26-18)20-16(24)21-19(4,5)15-10-8-9-14(12-15)13(2)3/h8-10,12H,2,6-7,11H2,1,3-5H3,(H2,20,21,22,24)