1-phenyl-3-[[2-(phenylmethylsulfanyl)imidazo[2,1-a]isoquinolin-3-yl]carbonylamino]thiourea

Systemtic Name: 1-phenyl-3-[[2-(phenylmethylsulfanyl)imidazo[2,1-a]isoquinolin-3-yl]carbonylamino]thiourea Openeye Name: 1-[(2-benzylsulfanylimidazo[2,1-a]isoquinoline-3-carbonyl)amino]-3-phenyl-thiourea CAS Name: 1-[[oxo-[2-(phenylmethylthio)-3-imidazo[2,1-a]isoquinolinyl]methyl]amino]-3-phenylthiourea IUPAC Name: 1-[(2-benzylsulfanylimidazo[2,1-a]isoquinoline-3-carbonyl)amino]-3-phenylthiourea Traditional Name: 1-[[2-(benzylthio)imidaz[2,1-a]isoquinoline-3-carbonyl]amino]-3-phenyl-thiourea Formula: C26H21N5OS2 MolecularWeight: 483.60784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(N3C=CC4=CC=CC=C4C3=N2)C(=O)NNC(=S)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(N3C=CC4=CC=CC=C4C3=N2)C(=O)NNC(=S)NC5=CC=CC=C5

InChI

InChI=1S/C26H21N5OS2/c32-24(29-30-26(33)27-20-12-5-2-6-13-20)22-25(34-17-18-9-3-1-4-10-18)28-23-21-14-8-7-11-19(21)15-16-31(22)23/h1-16H,17H2,(H,29,32)(H2,27,30,33)