methyl 2-azanyl-4-sulfanylidene-5H-1,5-benzoxazepine-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-sulfanylidene-5H-1,5-benzoxazepine-3-carboxylate Openeye Name: methyl 2-amino-4-thioxo-5H-1,5-benzoxazepine-3-carboxylate CAS Name: 2-amino-4-sulfanylidene-5H-1,5-benzoxazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-sulfanylidene-5H-1,5-benzoxazepine-3-carboxylate Traditional Name: 2-amino-4-thioxo-5H-1,5-benzoxazepine-3-carboxylic acid methyl ester Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=CC=CC=C2NC1=S)N

Isomeric SMILES

COC(=O)C1=C(OC2=CC=CC=C2NC1=S)N

InChI

InChI=1S/C11H10N2O3S/c1-15-11(14)8-9(12)16-7-5-3-2-4-6(7)13-10(8)17/h2-5H,12H2,1H3,(H,13,17)