1-ethyl-3-[5-[2-methyl-6-oxidanylidene-1-(pyridin-3-ylmethyl)pyridin-4-yl]-1,3-benzothiazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[5-[2-methyl-6-oxidanylidene-1-(pyridin-3-ylmethyl)pyridin-4-yl]-1,3-benzothiazol-2-yl]urea Openeye Name: 1-ethyl-3-[5-[2-methyl-6-oxo-1-(3-pyridylmethyl)-4-pyridyl]-1,3-benzothiazol-2-yl]urea CAS Name: 1-ethyl-3-[5-[2-methyl-6-oxo-1-(3-pyridinylmethyl)-4-pyridinyl]-1,3-benzothiazol-2-yl]urea IUPAC Name: 1-ethyl-3-[5-[2-methyl-6-oxo-1-(pyridin-3-ylmethyl)pyridin-4-yl]-1,3-benzothiazol-2-yl]urea Traditional Name: 1-ethyl-3-[5-[2-keto-6-methyl-1-(3-pyridylmethyl)-4-pyridyl]-1,3-benzothiazol-2-yl]urea Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(S1)C=CC(=C2)C3=CC(=O)N(C(=C3)C)CC4=CN=CC=C4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(S1)C=CC(=C2)C3=CC(=O)N(C(=C3)C)CC4=CN=CC=C4

InChI

InChI=1S/C22H21N5O2S/c1-3-24-21(29)26-22-25-18-10-16(6-7-19(18)30-22)17-9-14(2)27(20(28)11-17)13-15-5-4-8-23-12-15/h4-12H,3,13H2,1-2H3,(H2,24,25,26,29)