5-chloranyl-N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-chloranyl-N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-chloro-N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-chloro-N-[[(2-phenyl-1,3-benzoxazol-5-yl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-chloro-N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-chloro-N-[(2-phenyl-1,3-benzoxazol-5-yl)thiocarbamoyl]-1-naphthamide Formula: C25H16ClN3O2S MolecularWeight: 457.93144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Cl

InChI

InChI=1S/C25H16ClN3O2S/c26-20-11-5-8-17-18(20)9-4-10-19(17)23(30)29-25(32)27-16-12-13-22-21(14-16)28-24(31-22)15-6-2-1-3-7-15/h1-14H,(H2,27,29,30,32)