ethyl (3S)-4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]thiomorpholine-3-carboxylate

Systemtic Name: ethyl (3S)-4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]thiomorpholine-3-carboxylate Openeye Name: ethyl (3S)-4-[2-(4-bromoanilino)-2-oxo-ethyl]thiomorpholine-3-carboxylate CAS Name: (3S)-4-[2-(4-bromoanilino)-2-oxoethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-4-[2-(4-bromoanilino)-2-oxoethyl]thiomorpholine-3-carboxylate Traditional Name: (3S)-4-[2-(4-bromoanilino)-2-keto-ethyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C15H19BrN2O3S MolecularWeight: 387.29196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1CC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)[C@H]1CSCCN1CC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H19BrN2O3S/c1-2-21-15(20)13-10-22-8-7-18(13)9-14(19)17-12-5-3-11(16)4-6-12/h3-6,13H,2,7-10H2,1H3,(H,17,19)/t13-/m1/s1