1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(5-thiophen-2-ylpentanoylamino)urea

Systemtic Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(5-thiophen-2-ylpentanoylamino)urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-[5-(2-thienyl)pentanoylamino]urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-[(1-oxo-5-thiophen-2-ylpentyl)amino]urea IUPAC Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(5-thiophen-2-ylpentanoylamino)urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-[5-(2-thienyl)pentanoylamino]urea Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC(=O)CCCCC2=CC=CS2

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NNC(=O)CCCCC2=CC=CS2

InChI

InChI=1S/C22H29N3O2S/c1-16(2)17-9-7-10-18(15-17)22(3,4)23-21(27)25-24-20(26)13-6-5-11-19-12-8-14-28-19/h7-10,12,14-15H,1,5-6,11,13H2,2-4H3,(H,24,26)(H2,23,25,27)