1-(4-butylphenyl)-3-[(6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]urea

Systemtic Name: 1-(4-butylphenyl)-3-[(6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]urea Openeye Name: 1-(4-butylphenyl)-3-[(6-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]urea CAS Name: 1-(4-butylphenyl)-3-[[(6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]urea IUPAC Name: 1-(4-butylphenyl)-3-[(6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]urea Traditional Name: 1-(4-butylphenyl)-3-[(6-ethyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]urea Formula: C22H29N3O2S MolecularWeight: 399.54956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)NNC(=O)C2=CC3=C(S2)CC(CC3)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)NNC(=O)C2=CC3=C(S2)CC(CC3)CC

InChI

InChI=1S/C22H29N3O2S/c1-3-5-6-16-8-11-18(12-9-16)23-22(27)25-24-21(26)20-14-17-10-7-15(4-2)13-19(17)28-20/h8-9,11-12,14-15H,3-7,10,13H2,1-2H3,(H,24,26)(H2,23,25,27)