N2-(1,3-benzothiazol-6-yl)-N4-(cyclohexylmethyl)-N4-methyl-6-piperazin-1-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(1,3-benzothiazol-6-yl)-N4-(cyclohexylmethyl)-N4-methyl-6-piperazin-1-yl-1,3,5-triazine-2,4-diamine Openeye Name: N2-(1,3-benzothiazol-6-yl)-N4-(cyclohexylmethyl)-N4-methyl-6-piperazin-1-yl-1,3,5-triazine-2,4-diamine CAS Name: N2-(1,3-benzothiazol-6-yl)-N4-(cyclohexylmethyl)-N4-methyl-6-(1-piperazinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(1,3-benzothiazol-6-yl)-4-N-(cyclohexylmethyl)-4-N-methyl-6-piperazin-1-yl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(1,3-benzothiazol-6-ylamino)-6-piperazino-s-triazin-2-yl]-(cyclohexylmethyl)-methyl-amine Formula: C22H30N8S MolecularWeight: 438.5922

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCCCC1)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=CS4)N5CCNCC5

Isomeric SMILES

CN(CC1CCCCC1)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=CS4)N5CCNCC5

InChI

InChI=1S/C22H30N8S/c1-29(14-16-5-3-2-4-6-16)21-26-20(27-22(28-21)30-11-9-23-10-12-30)25-17-7-8-18-19(13-17)31-15-24-18/h7-8,13,15-16,23H,2-6,9-12,14H2,1H3,(H,25,26,27,28)