1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(2-pyridin-2-ylethyl)urea

Systemtic Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(2-pyridin-2-ylethyl)urea Openeye Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-[2-(2-pyridyl)ethyl]urea CAS Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-[2-(2-pyridinyl)ethyl]urea IUPAC Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(2-pyridin-2-ylethyl)urea Traditional Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-[2-(2-pyridyl)ethyl]urea Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)NCCC4=CC=CC=N4

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C22H20N4O2S/c1-28-18-11-10-17(15-7-3-2-4-8-15)20-19(18)25-22(29-20)26-21(27)24-14-12-16-9-5-6-13-23-16/h2-11,13H,12,14H2,1H3,(H2,24,25,26,27)