N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-2-[4-(1-pyrazolylmethyl)phenyl]benzamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Formula: C28H25N5O2S MolecularWeight: 495.5954

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=C(C=C5)CN6C=CC=N6

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=C(C=C5)CN6C=CC=N6

InChI

InChI=1S/C28H25N5O2S/c34-27(30-22-10-11-25-26(18-22)36-28(31-25)32-14-16-35-17-15-32)24-5-2-1-4-23(24)21-8-6-20(7-9-21)19-33-13-3-12-29-33/h1-13,18H,14-17,19H2,(H,30,34)