N1,N4-bis(1,3-benzothiazol-6-yl)phthalazine-1,4-diamine

Systemtic Name: N1,N4-bis(1,3-benzothiazol-6-yl)phthalazine-1,4-diamine Openeye Name: N1,N4-bis(1,3-benzothiazol-6-yl)phthalazine-1,4-diamine CAS Name: N1,N4-bis(1,3-benzothiazol-6-yl)phthalazine-1,4-diamine IUPAC Name: 1-N,4-N-bis(1,3-benzothiazol-6-yl)phthalazine-1,4-diamine Traditional Name: 1,3-benzothiazol-6-yl-[4-(1,3-benzothiazol-6-ylamino)phthalazin-1-yl]amine Formula: C22H14N6S2 MolecularWeight: 426.51676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2NC3=CC4=C(C=C3)N=CS4)NC5=CC6=C(C=C5)N=CS6

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NC3=CC4=C(C=C3)N=CS4)NC5=CC6=C(C=C5)N=CS6

InChI

InChI=1S/C22H14N6S2/c1-2-4-16-15(3-1)21(25-13-5-7-17-19(9-13)29-11-23-17)27-28-22(16)26-14-6-8-18-20(10-14)30-12-24-18/h1-12H,(H,25,27)(H,26,28)