1-[[2-(4-butan-2-ylphenyl)quinolin-4-yl]carbonylamino]-1-ethyl-thiourea

Systemtic Name: 1-[[2-(4-butan-2-ylphenyl)quinolin-4-yl]carbonylamino]-1-ethyl-thiourea Openeye Name: 1-ethyl-1-[[2-(4-sec-butylphenyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-[[[2-(4-butan-2-ylphenyl)-4-quinolinyl]-oxomethyl]amino]-1-ethylthiourea IUPAC Name: 1-[[2-(4-butan-2-ylphenyl)quinoline-4-carbonyl]amino]-1-ethylthiourea Traditional Name: 1-ethyl-1-[[2-(4-sec-butylphenyl)quinoline-4-carbonyl]amino]thiourea Formula: C23H26N4OS MolecularWeight: 406.54374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN(CC)C(=S)N

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NN(CC)C(=S)N

InChI

InChI=1S/C23H26N4OS/c1-4-15(3)16-10-12-17(13-11-16)21-14-19(18-8-6-7-9-20(18)25-21)22(28)26-27(5-2)23(24)29/h6-15H,4-5H2,1-3H3,(H2,24,29)(H,26,28)