methyl 4-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfonyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylate

Systemtic Name: methyl 4-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfonyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylate Openeye Name: methyl 4-(2-amino-4-methyl-thiazol-5-yl)sulfonyl-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylate CAS Name: 4-[(2-amino-4-methyl-5-thiazolyl)sulfonyl]-1-(4-methoxyphenyl)sulfonyl-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfonyl]-1-(4-methoxyphenyl)sulfonylpiperazine-2-carboxylate Traditional Name: 4-(2-amino-4-methyl-thiazol-5-yl)sulfonyl-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylic acid methyl ester Formula: C17H22N4O7S3 MolecularWeight: 490.57418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)S(=O)(=O)N2CCN(C(C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(SC(=N1)N)S(=O)(=O)N2CCN(C(C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H22N4O7S3/c1-11-16(29-17(18)19-11)31(25,26)20-8-9-21(14(10-20)15(22)28-3)30(23,24)13-6-4-12(27-2)5-7-13/h4-7,14H,8-10H2,1-3H3,(H2,18,19)