1-[[2-(2-ethoxyphenyl)quinolin-4-yl]carbonylamino]-3-ethyl-thiourea

Systemtic Name: 1-[[2-(2-ethoxyphenyl)quinolin-4-yl]carbonylamino]-3-ethyl-thiourea Openeye Name: 1-[[2-(2-ethoxyphenyl)quinoline-4-carbonyl]amino]-3-ethyl-thiourea CAS Name: 1-[[[2-(2-ethoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-3-ethylthiourea IUPAC Name: 1-[[2-(2-ethoxyphenyl)quinoline-4-carbonyl]amino]-3-ethylthiourea Traditional Name: 1-ethyl-3-[(2-o-phenetylquinoline-4-carbonyl)amino]thiourea Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3OCC

Isomeric SMILES

CCNC(=S)NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3OCC

InChI

InChI=1S/C21H22N4O2S/c1-3-22-21(28)25-24-20(26)16-13-18(23-17-11-7-5-9-14(16)17)15-10-6-8-12-19(15)27-4-2/h5-13H,3-4H2,1-2H3,(H,24,26)(H2,22,25,28)