N-[(2S)-butan-2-yl]-2-ethylsulfonyl-4-(4-methylphenyl)sulfonyl-1,3-thiazol-5-amine

Systemtic Name: N-[(2S)-butan-2-yl]-2-ethylsulfonyl-4-(4-methylphenyl)sulfonyl-1,3-thiazol-5-amine Openeye Name: 2-ethylsulfonyl-N-[(1S)-1-methylpropyl]-4-(p-tolylsulfonyl)thiazol-5-amine CAS Name: N-[(2S)-butan-2-yl]-2-ethylsulfonyl-4-(4-methylphenyl)sulfonyl-5-thiazolamine IUPAC Name: N-[(2S)-butan-2-yl]-2-ethylsulfonyl-4-(4-methylphenyl)sulfonyl-1,3-thiazol-5-amine Traditional Name: (2-esyl-4-tosyl-thiazol-5-yl)-[(1S)-1-methylpropyl]amine Formula: C16H22N2O4S3 MolecularWeight: 402.55188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(N=C(S1)S(=O)(=O)CC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC[C@H](C)NC1=C(N=C(S1)S(=O)(=O)CC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H22N2O4S3/c1-5-12(4)17-14-15(18-16(23-14)24(19,20)6-2)25(21,22)13-9-7-11(3)8-10-13/h7-10,12,17H,5-6H2,1-4H3/t12-/m0/s1