N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-2-(4-thiazolylmethylthio)benzamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-2-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-(thiazol-4-ylmethylthio)benzamide Formula: C22H20N4O2S3 MolecularWeight: 468.6148

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4SCC5=CSC=N5

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC=C4SCC5=CSC=N5

InChI

InChI=1S/C22H20N4O2S3/c27-21(17-3-1-2-4-19(17)30-13-16-12-29-14-23-16)24-15-5-6-18-20(11-15)31-22(25-18)26-7-9-28-10-8-26/h1-6,11-12,14H,7-10,13H2,(H,24,27)