1-phenethyl-3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-phenethyl-3-[(2-pyridin-4-ylquinolin-4-yl)carbonylamino]thiourea Openeye Name: 1-phenethyl-3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiourea CAS Name: 1-[[oxo-(2-pyridin-4-yl-4-quinolinyl)methyl]amino]-3-phenethylthiourea IUPAC Name: 1-phenethyl-3-[(2-pyridin-4-ylquinoline-4-carbonyl)amino]thiourea Traditional Name: 1-phenethyl-3-[[2-(4-pyridyl)quinoline-4-carbonyl]amino]thiourea Formula: C24H21N5OS MolecularWeight: 427.52144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C24H21N5OS/c30-23(28-29-24(31)26-15-10-17-6-2-1-3-7-17)20-16-22(18-11-13-25-14-12-18)27-21-9-5-4-8-19(20)21/h1-9,11-14,16H,10,15H2,(H,28,30)(H2,26,29,31)