methyl 4-[(5-azanyl-4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(5-azanyl-4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(5-amino-4-phenyl-thiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(5-amino-4-phenyl-2-thiazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-amino-4-phenyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(5-amino-4-phenyl-thiazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NC(=C(S2)N)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NC(=C(S2)N)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S2/c1-22-17(21)14-9-7-12(8-10-14)11-23-18-20-15(16(19)24-18)13-5-3-2-4-6-13/h2-10H,11,19H2,1H3