N-[3-(1,3-benzothiazol-2-yl)propyl]-4-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-(propargylsulfamoyl)benzamide Formula: C20H19N3O3S2 MolecularWeight: 413.51316

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H19N3O3S2/c1-2-13-22-28(25,26)16-11-9-15(10-12-16)20(24)21-14-5-8-19-23-17-6-3-4-7-18(17)27-19/h1,3-4,6-7,9-12,22H,5,8,13-14H2,(H,21,24)