5-bromanyl-N-[[4-[(2-chlorophenyl)carbonylamino]-3-methoxy-phenyl]carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[[4-[(2-chlorophenyl)carbonylamino]-3-methoxy-phenyl]carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[[4-[(2-chlorobenzoyl)amino]-3-methoxy-phenyl]carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[4-[[(2-chlorophenyl)-oxomethyl]amino]-3-methoxyanilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[[4-[(2-chlorobenzoyl)amino]-3-methoxy-phenyl]thiocarbamoyl]-1-naphthamide Formula: C26H19BrClN3O3S MolecularWeight: 568.86936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C26H19BrClN3O3S/c1-34-23-14-15(12-13-22(23)30-25(33)19-6-2-3-11-21(19)28)29-26(35)31-24(32)18-9-4-8-17-16(18)7-5-10-20(17)27/h2-14H,1H3,(H,30,33)(H2,29,31,32,35)