(2S)-4-[(3-bromophenyl)carbamothioyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-[(3-bromophenyl)carbamothioyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[(3-bromophenyl)carbamothioyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[(3-bromoanilino)-sulfanylidenemethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-[(3-bromophenyl)carbamothioyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-[(3-bromophenyl)thiocarbamoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C(=S)NC3=CC(=CC=C3)Br)C(=O)N

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2N1C(=S)NC3=CC(=CC=C3)Br)C(=O)N

InChI

InChI=1S/C16H14BrN3O2S/c17-10-4-3-5-11(8-10)19-16(23)20-9-14(15(18)21)22-13-7-2-1-6-12(13)20/h1-8,14H,9H2,(H2,18,21)(H,19,23)/t14-/m0/s1