methyl 2-[(5-chloranyl-2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoate

Systemtic Name: methyl 2-[(5-chloranyl-2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoate Openeye Name: methyl 2-[(5-chloro-2-thioxo-1,3-benzoxazol-3-yl)methylamino]benzoate CAS Name: 2-[(5-chloro-2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoate Traditional Name: 2-[(5-chloro-2-thioxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid methyl ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NCN2C3=C(C=CC(=C3)Cl)OC2=S

Isomeric SMILES

COC(=O)C1=CC=CC=C1NCN2C3=C(C=CC(=C3)Cl)OC2=S

InChI

InChI=1S/C16H13ClN2O3S/c1-21-15(20)11-4-2-3-5-12(11)18-9-19-13-8-10(17)6-7-14(13)22-16(19)23/h2-8,18H,9H2,1H3