1-[[6-bromanyl-2-(4-tert-butylphenyl)quinolin-4-yl]carbonylamino]-3-ethyl-thiourea

Systemtic Name: 1-[[6-bromanyl-2-(4-tert-butylphenyl)quinolin-4-yl]carbonylamino]-3-ethyl-thiourea Openeye Name: 1-[[6-bromo-2-(4-tert-butylphenyl)quinoline-4-carbonyl]amino]-3-ethyl-thiourea CAS Name: 1-[[[6-bromo-2-(4-tert-butylphenyl)-4-quinolinyl]-oxomethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[6-bromo-2-(4-tert-butylphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea Traditional Name: 1-[[6-bromo-2-(4-tert-butylphenyl)quinoline-4-carbonyl]amino]-3-ethyl-thiourea Formula: C23H25BrN4OS MolecularWeight: 485.4398

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCNC(=S)NNC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H25BrN4OS/c1-5-25-22(30)28-27-21(29)18-13-20(26-19-11-10-16(24)12-17(18)19)14-6-8-15(9-7-14)23(2,3)4/h6-13H,5H2,1-4H3,(H,27,29)(H2,25,28,30)