N'-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-N-(furan-2-ylmethyl)pentanediamide

Systemtic Name: N'-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-N-(furan-2-ylmethyl)pentanediamide Openeye Name: N'-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-N-(2-furylmethyl)pentanediamide CAS Name: N'-[2-(1-benzotriazolylmethylthio)-1,3-benzothiazol-6-yl]-N-(2-furanylmethyl)pentanediamide IUPAC Name: N'-[2-(benzotriazol-1-ylmethylsulfanyl)-1,3-benzothiazol-6-yl]-N-(furan-2-ylmethyl)pentanediamide Traditional Name: N'-[2-(benzotriazol-1-ylmethylthio)-1,3-benzothiazol-6-yl]-N-(2-furfuryl)glutaramide Formula: C24H22N6O3S2 MolecularWeight: 506.59988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CSC3=NC4=C(S3)C=C(C=C4)NC(=O)CCCC(=O)NCC5=CC=CO5

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CSC3=NC4=C(S3)C=C(C=C4)NC(=O)CCCC(=O)NCC5=CC=CO5

InChI

InChI=1S/C24H22N6O3S2/c31-22(25-14-17-5-4-12-33-17)8-3-9-23(32)26-16-10-11-19-21(13-16)35-24(27-19)34-15-30-20-7-2-1-6-18(20)28-29-30/h1-2,4-7,10-13H,3,8-9,14-15H2,(H,25,31)(H,26,32)