1-methyl-3-[[2-(2-propan-2-yloxyphenyl)quinolin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-methyl-3-[[2-(2-propan-2-yloxyphenyl)quinolin-4-yl]carbonylamino]thiourea Openeye Name: 1-[[2-(2-isopropoxyphenyl)quinoline-4-carbonyl]amino]-3-methyl-thiourea CAS Name: 1-methyl-3-[[oxo-[2-(2-propan-2-yloxyphenyl)-4-quinolinyl]methyl]amino]thiourea IUPAC Name: 1-methyl-3-[[2-(2-propan-2-yloxyphenyl)quinoline-4-carbonyl]amino]thiourea Traditional Name: 1-[[2-(2-isopropoxyphenyl)quinoline-4-carbonyl]amino]-3-methyl-thiourea Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC

InChI

InChI=1S/C21H22N4O2S/c1-13(2)27-19-11-7-5-9-15(19)18-12-16(20(26)24-25-21(28)22-3)14-8-4-6-10-17(14)23-18/h4-13H,1-3H3,(H,24,26)(H2,22,25,28)