N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(thiophen-2-ylsulfonylamino)benzenecarboximidate

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(thiophen-2-ylsulfonylamino)benzenecarboximidate Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-thienylsulfonylamino)benzenecarboximidate CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(thiophen-2-ylsulfonylamino)benzenecarboximidate IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(thiophen-2-ylsulfonylamino)benzenecarboximidate Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(2-thienylsulfonylamino)benzenecarboximidate Formula: C20H16N3O3S3- MolecularWeight: 442.55434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N=C(C3=CC=CC=C3NS(=O)(=O)C4=CC=CS4)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N=C(C3=CC=CC=C3NS(=O)(=O)C4=CC=CS4)[O-])C

InChI

InChI=1S/C20H17N3O3S3/c1-12-10-13(2)18-16(11-12)28-20(21-18)22-19(24)14-6-3-4-7-15(14)23-29(25,26)17-8-5-9-27-17/h3-11,23H,1-2H3,(H,21,22,24)/p-1