N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide Formula: C18H16BrN3O4S2 MolecularWeight: 482.37134

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C18H16BrN3O4S2/c19-13-3-6-15-16(11-13)27-18(20-15)21-17(23)12-1-4-14(5-2-12)28(24,25)22-7-9-26-10-8-22/h1-6,11H,7-10H2,(H,20,21,23)