1,1-bis[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(4,6-dimethylpyrimidin-2-yl)methanimine

Systemtic Name: 1,1-bis[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(4,6-dimethylpyrimidin-2-yl)methanimine Openeye Name: 1,1-bis[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(4,6-dimethylpyrimidin-2-yl)methanimine CAS Name: 1,1-bis[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-N-(4,6-dimethyl-2-pyrimidinyl)methanimine IUPAC Name: 1,1-bis[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(4,6-dimethylpyrimidin-2-yl)methanimine Traditional Name: bis[4-(1,2-benzothiazol-3-yl)piperazino]methylene-(4,6-dimethylpyrimidin-2-yl)amine Formula: C29H31N9S2 MolecularWeight: 569.74674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N2CCN(CC2)C3=NSC4=CC=CC=C43)N5CCN(CC5)C6=NSC7=CC=CC=C76)C

Isomeric SMILES

CC1=CC(=NC(=N1)N=C(N2CCN(CC2)C3=NSC4=CC=CC=C43)N5CCN(CC5)C6=NSC7=CC=CC=C76)C

InChI

InChI=1S/C29H31N9S2/c1-20-19-21(2)31-28(30-20)32-29(37-15-11-35(12-16-37)26-22-7-3-5-9-24(22)39-33-26)38-17-13-36(14-18-38)27-23-8-4-6-10-25(23)40-34-27/h3-10,19H,11-18H2,1-2H3