ethyl 2-[(2-azanyl-5-bromanyl-phenyl)amino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-azanyl-5-bromanyl-phenyl)amino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(2-amino-5-bromo-anilino)benzothiophene-3-carboxylate CAS Name: 2-(2-amino-5-bromoanilino)-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-amino-5-bromoanilino)-1-benzothiophene-3-carboxylate Traditional Name: 2-(2-amino-5-bromo-anilino)benzothiophene-3-carboxylic acid ethyl ester Formula: C17H15BrN2O2S MolecularWeight: 391.2822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC3=C(C=CC(=C3)Br)N

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC3=C(C=CC(=C3)Br)N

InChI

InChI=1S/C17H15BrN2O2S/c1-2-22-17(21)15-11-5-3-4-6-14(11)23-16(15)20-13-9-10(18)7-8-12(13)19/h3-9,20H,2,19H2,1H3