1-[[(Z)-1-(4-chlorophenyl)-2-(3-pyridin-2-ylisoquinolin-1-yl)ethenyl]amino]thiourea

Systemtic Name: 1-[[(Z)-1-(4-chlorophenyl)-2-(3-pyridin-2-ylisoquinolin-1-yl)ethenyl]amino]thiourea Openeye Name: [[(Z)-1-(4-chlorophenyl)-2-[3-(2-pyridyl)-1-isoquinolyl]vinyl]amino]thiourea CAS Name: [[(Z)-1-(4-chlorophenyl)-2-[3-(2-pyridinyl)-1-isoquinolinyl]ethenyl]amino]thiourea IUPAC Name: [[(Z)-1-(4-chlorophenyl)-2-(3-pyridin-2-ylisoquinolin-1-yl)ethenyl]amino]thiourea Traditional Name: [[(Z)-1-(4-chlorophenyl)-2-[3-(2-pyridyl)-1-isoquinolyl]vinyl]amino]thiourea Formula: C23H18ClN5S MolecularWeight: 431.94052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N=C2C=C(C3=CC=C(C=C3)Cl)NNC(=S)N)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N=C2/C=C(/C3=CC=C(C=C3)Cl)\NNC(=S)N)C4=CC=CC=N4

InChI

InChI=1S/C23H18ClN5S/c24-17-10-8-15(9-11-17)20(28-29-23(25)30)14-21-18-6-2-1-5-16(18)13-22(27-21)19-7-3-4-12-26-19/h1-14,28H,(H3,25,29,30)/b20-14-