N-(1,3-benzothiazol-2-yl)-N-ethyl-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C18H21N3O3S3 MolecularWeight: 423.57264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)CCCN(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)CCCN(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H21N3O3S3/c1-3-21(18-19-14-8-4-5-9-15(14)26-18)16(22)10-6-12-20(2)27(23,24)17-11-7-13-25-17/h4-5,7-9,11,13H,3,6,10,12H2,1-2H3