N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H25N3O4S3 MolecularWeight: 479.6359

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C)OC

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)C)OC

InChI

InChI=1S/C21H25N3O4S3/c1-4-24-18-16(28-3)8-7-14(2)19(18)30-21(24)22-20(25)15-9-11-23(12-10-15)31(26,27)17-6-5-13-29-17/h5-8,13,15H,4,9-12H2,1-3H3