methyl 2-azanyl-5,5-dimethyl-4H-benzo[e][1]benzothiole-1-carboxylate

Systemtic Name: methyl 2-azanyl-5,5-dimethyl-4H-benzo[e][1]benzothiole-1-carboxylate Openeye Name: methyl 2-amino-5,5-dimethyl-4H-benzo[e]benzothiophene-1-carboxylate CAS Name: 2-amino-5,5-dimethyl-4H-benzo[e][1]benzothiole-1-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-5,5-dimethyl-4H-benzo[e][1]benzothiole-1-carboxylate Traditional Name: 2-amino-5,5-dimethyl-4H-benzo[e]benzothiophene-1-carboxylic acid methyl ester Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C3=CC=CC=C31)C(=C(S2)N)C(=O)OC)C

Isomeric SMILES

CC1(CC2=C(C3=CC=CC=C31)C(=C(S2)N)C(=O)OC)C

InChI

InChI=1S/C16H17NO2S/c1-16(2)8-11-12(9-6-4-5-7-10(9)16)13(14(17)20-11)15(18)19-3/h4-7H,8,17H2,1-3H3