N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[butyl(ethyl)sulfamoyl]benzamide

Systemtic Name: N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[butyl(ethyl)sulfamoyl]benzamide Openeye Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[butyl(ethyl)sulfamoyl]benzamide CAS Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[butyl(ethyl)sulfamoyl]benzamide IUPAC Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-[butyl(ethyl)sulfamoyl]benzamide Traditional Name: N-(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)-4-[butyl(ethyl)sulfamoyl]benzamide Formula: C23H24BrN3O3S2 MolecularWeight: 534.48896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC#C

Isomeric SMILES

CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC#C

InChI

InChI=1S/C23H24BrN3O3S2/c1-4-7-15-26(6-3)32(29,30)19-11-8-17(9-12-19)22(28)25-23-27(14-5-2)20-13-10-18(24)16-21(20)31-23/h2,8-13,16H,4,6-7,14-15H2,1,3H3