N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-6-chloranyl-naphthalene-2-sulfonamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-6-chloranyl-naphthalene-2-sulfonamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-6-chloro-naphthalene-2-sulfonamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-2-thiophenyl]-6-chloro-2-naphthalenesulfonamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)thiophen-2-yl]-6-chloronaphthalene-2-sulfonamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-thienyl]-6-chloro-naphthalene-2-sulfonamide Formula: C21H13ClN2O2S3 MolecularWeight: 456.98812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(SC=C3)NS(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(SC=C3)NS(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C21H13ClN2O2S3/c22-15-7-5-14-12-16(8-6-13(14)11-15)29(25,26)24-21-17(9-10-27-21)20-23-18-3-1-2-4-19(18)28-20/h1-12,24H