N-[(2-aminocarbonylphenyl)carbamothioyl]-3,5-bis(bromanyl)-2-methoxy-benzamide

Systemtic Name: N-[(2-aminocarbonylphenyl)carbamothioyl]-3,5-bis(bromanyl)-2-methoxy-benzamide Openeye Name: 3,5-dibromo-N-[(2-carbamoylphenyl)carbamothioyl]-2-methoxy-benzamide CAS Name: 3,5-dibromo-N-[(2-carbamoylanilino)-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 3,5-dibromo-N-[(2-carbamoylphenyl)carbamothioyl]-2-methoxybenzamide Traditional Name: 3,5-dibromo-N-[(2-carbamoylphenyl)thiocarbamoyl]-2-methoxy-benzamide Formula: C16H13Br2N3O3S MolecularWeight: 487.16572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)N)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)N)Br)Br

InChI

InChI=1S/C16H13Br2N3O3S/c1-24-13-10(6-8(17)7-11(13)18)15(23)21-16(25)20-12-5-3-2-4-9(12)14(19)22/h2-7H,1H3,(H2,19,22)(H2,20,21,23,25)