methyl 2-[[cyclopropyl-[(E)-2-phenylethenyl]sulfonyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[cyclopropyl-[(E)-2-phenylethenyl]sulfonyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[cyclopropyl-[(E)-styryl]sulfonyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclopropyl-[(E)-2-phenylethenyl]sulfonylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclopropyl-[(E)-2-phenylethenyl]sulfonylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclopropyl-[(E)-styryl]sulfonyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)CN(C2CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CSC(=N1)CN(C2CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O4S2/c1-23-17(20)15-12-24-16(18-15)11-19(14-7-8-14)25(21,22)10-9-13-5-3-2-4-6-13/h2-6,9-10,12,14H,7-8,11H2,1H3/b10-9+