6-(2-azanyl-4-methyl-1,3-thiazol-5-yl)-N2-(3-piperazin-1-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(2-azanyl-4-methyl-1,3-thiazol-5-yl)-N2-(3-piperazin-1-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(2-amino-4-methyl-thiazol-5-yl)-N2-(3-piperazin-1-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-(2-amino-4-methyl-5-thiazolyl)-N2-[3-(1-piperazinylsulfonyl)phenyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-N-(3-piperazin-1-ylsulfonylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(2-amino-4-methyl-thiazol-5-yl)-s-triazin-2-yl]-(3-piperazinosulfonylphenyl)amine Formula: C17H21N9O2S2 MolecularWeight: 447.53774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)C2=NC(=NC(=N2)NC3=CC(=CC=C3)S(=O)(=O)N4CCNCC4)N

Isomeric SMILES

CC1=C(SC(=N1)N)C2=NC(=NC(=N2)NC3=CC(=CC=C3)S(=O)(=O)N4CCNCC4)N

InChI

InChI=1S/C17H21N9O2S2/c1-10-13(29-16(19)21-10)14-23-15(18)25-17(24-14)22-11-3-2-4-12(9-11)30(27,28)26-7-5-20-6-8-26/h2-4,9,20H,5-8H2,1H3,(H2,19,21)(H3,18,22,23,24,25)