2-chloranylprop-2-enyl 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzoate

Systemtic Name: 2-chloranylprop-2-enyl 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzoate Openeye Name: 2-chloroallyl 4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzoate CAS Name: 4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzoate Traditional Name: 4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzoic acid 2-chloroallyl ester Formula: C14H11ClN2O4S2 MolecularWeight: 370.83114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)OCC(=C)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)OCC(=C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClN2O4S2/c1-8(15)6-21-13(18)10-3-4-12(11(5-10)17(19)20)23-14-16-9(2)7-22-14/h3-5,7H,1,6H2,2H3