(NZ)-N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide

Systemtic Name: (NZ)-N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide Openeye Name: (NZ)-N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide CAS Name: (NZ)-N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-thiophenesulfonamide IUPAC Name: (NZ)-N-(6-butyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide Traditional Name: (NZ)-N-(6-butyl-3-propargyl-1,3-benzothiazol-2-ylidene)thiophene-2-sulfonamide Formula: C18H18N2O2S3 MolecularWeight: 390.54272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=NS(=O)(=O)C3=CC=CS3)S2)CC#C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(/C(=N/S(=O)(=O)C3=CC=CS3)/S2)CC#C

InChI

InChI=1S/C18H18N2O2S3/c1-3-5-7-14-9-10-15-16(13-14)24-18(20(15)11-4-2)19-25(21,22)17-8-6-12-23-17/h2,6,8-10,12-13H,3,5,7,11H2,1H3/b19-18-