2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N,N'-bis(phenylmethyl)butanediamide

Systemtic Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]-N,N'-bis(phenylmethyl)butanediamide Openeye Name: N,N'-dibenzyl-2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]butanediamide CAS Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)thio]-N,N'-bis(phenylmethyl)butanediamide IUPAC Name: N,N'-dibenzyl-2-[(6-methoxy-1,3-benzothiazol-2-yl)sulfanyl]butanediamide Traditional Name: N,N'-dibenzyl-2-[(6-methoxy-1,3-benzothiazol-2-yl)thio]succinamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)SC(CC(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)SC(CC(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3S2/c1-32-20-12-13-21-22(14-20)33-26(29-21)34-23(25(31)28-17-19-10-6-3-7-11-19)15-24(30)27-16-18-8-4-2-5-9-18/h2-14,23H,15-17H2,1H3,(H,27,30)(H,28,31)