1-(1,3-thiazol-2-yl)-3-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea

Systemtic Name: 1-(1,3-thiazol-2-yl)-3-(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)urea Openeye Name: 1-thiazol-2-yl-3-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolyl)urea CAS Name: 1-(2-thiazolyl)-3-(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinyl)urea IUPAC Name: 1-(1,3-thiazol-2-yl)-3-(2,6,7-trimethyl-1-oxo-4-phenylisoquinolin-3-yl)urea Traditional Name: 1-(1-keto-2,6,7-trimethyl-4-phenyl-3-isoquinolyl)-3-thiazol-2-yl-urea Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)NC(=O)NC3=NC=CS3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)NC(=O)NC3=NC=CS3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H20N4O2S/c1-13-11-16-17(12-14(13)2)20(27)26(3)19(18(16)15-7-5-4-6-8-15)24-21(28)25-22-23-9-10-29-22/h4-12H,1-3H3,(H2,23,24,25,28)