3-(3-methoxypropyl)-1-methyl-1-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiourea

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(2-thienyl)quinoline-4-carbonyl]amino]thiourea Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C20H22N4O2S2/c1-24(20(27)21-10-6-11-26-2)23-19(25)15-13-17(18-9-5-12-28-18)22-16-8-4-3-7-14(15)16/h3-5,7-9,12-13H,6,10-11H2,1-2H3,(H,21,27)(H,23,25)