N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(2-phenylethenylsulfonyl)ethanamide

Systemtic Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(2-phenylethenylsulfonyl)ethanamide Openeye Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-styrylsulfonyl-acetamide CAS Name: N-[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]-2-(2-phenylethenylsulfonyl)acetamide IUPAC Name: N-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(2-phenylethenylsulfonyl)acetamide Traditional Name: N-[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]-2-styrylsulfonyl-acetamide Formula: C24H19N5O3S3 MolecularWeight: 521.63436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CS(=O)(=O)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)C=CS(=O)(=O)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H19N5O3S3/c30-23(15-35(31,32)13-12-17-6-2-1-3-7-17)25-18-10-11-20-22(14-18)34-24(26-20)33-16-29-21-9-5-4-8-19(21)27-28-29/h1-14H,15-16H2,(H,25,30)