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

Systemtic Name: 1-[[2-(3-butoxyphenyl)quinolin-4-yl]carbonylamino]-3-methyl-thiourea Openeye Name: 1-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]-3-methyl-thiourea CAS Name: 1-[[[2-(3-butoxyphenyl)-4-quinolinyl]-oxomethyl]amino]-3-methylthiourea IUPAC Name: 1-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]-3-methylthiourea Traditional Name: 1-[[2-(3-butoxyphenyl)quinoline-4-carbonyl]amino]-3-methyl-thiourea Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC

InChI

InChI=1S/C22H24N4O2S/c1-3-4-12-28-16-9-7-8-15(13-16)20-14-18(21(27)25-26-22(29)23-2)17-10-5-6-11-19(17)24-20/h5-11,13-14H,3-4,12H2,1-2H3,(H,25,27)(H2,23,26,29)