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

Systemtic Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(pyridin-3-ylmethyl)urea Openeye Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(3-pyridylmethyl)urea CAS Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(3-pyridinylmethyl)urea IUPAC Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(pyridin-3-ylmethyl)urea Traditional Name: 1-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)-3-(3-pyridylmethyl)urea Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)NCC4=CN=CC=C4

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CC=CC=C3)SC(=N2)NC(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H18N4O2S/c1-27-17-10-9-16(15-7-3-2-4-8-15)19-18(17)24-21(28-19)25-20(26)23-13-14-6-5-11-22-12-14/h2-12H,13H2,1H3,(H2,23,24,25,26)