5-(4-chlorophenyl)-N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[[[2-(1-naphthalenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-furamide Formula: C29H18ClN3O3S MolecularWeight: 523.98952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC=C(O5)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC=C(O5)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C29H18ClN3O3S/c30-19-10-8-18(9-11-19)24-14-15-26(35-24)27(34)33-29(37)31-20-12-13-25-23(16-20)32-28(36-25)22-7-3-5-17-4-1-2-6-21(17)22/h1-16H,(H2,31,33,34,37)