N1,N4-bis(1,3-benzothiazol-2-ylsulfanylmethyl)benzene-1,4-diamine

Systemtic Name: N1,N4-bis(1,3-benzothiazol-2-ylsulfanylmethyl)benzene-1,4-diamine Openeye Name: N1,N4-bis(1,3-benzothiazol-2-ylsulfanylmethyl)benzene-1,4-diamine CAS Name: N1,N4-bis[(1,3-benzothiazol-2-ylthio)methyl]benzene-1,4-diamine IUPAC Name: 1-N,4-N-bis(1,3-benzothiazol-2-ylsulfanylmethyl)benzene-1,4-diamine Traditional Name: (1,3-benzothiazol-2-ylthio)methyl-[4-[(1,3-benzothiazol-2-ylthio)methylamino]phenyl]amine Formula: C22H18N4S4 MolecularWeight: 466.66512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCNC3=CC=C(C=C3)NCSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCNC3=CC=C(C=C3)NCSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H18N4S4/c1-3-7-19-17(5-1)25-21(29-19)27-13-23-15-9-11-16(12-10-15)24-14-28-22-26-18-6-2-4-8-20(18)30-22/h1-12,23-24H,13-14H2