N-(2-carbamothioyl-4-oxidanylidene-chromen-6-yl)-9-phenyl-nonanamide

Systemtic Name: N-(2-carbamothioyl-4-oxidanylidene-chromen-6-yl)-9-phenyl-nonanamide Openeye Name: N-(2-carbamothioyl-4-oxo-chromen-6-yl)-9-phenyl-nonanamide CAS Name: N-(2-carbamothioyl-4-oxo-1-benzopyran-6-yl)-9-phenylnonanamide IUPAC Name: N-(2-carbamothioyl-4-oxochromen-6-yl)-9-phenylnonanamide Traditional Name: N-(4-keto-2-thiocarbamoyl-chromen-6-yl)-9-phenyl-pelargonamide Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCC(=O)NC2=CC3=C(C=C2)OC(=CC3=O)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCC(=O)NC2=CC3=C(C=C2)OC(=CC3=O)C(=S)N

InChI

InChI=1S/C25H28N2O3S/c26-25(31)23-17-21(28)20-16-19(14-15-22(20)30-23)27-24(29)13-9-4-2-1-3-6-10-18-11-7-5-8-12-18/h5,7-8,11-12,14-17H,1-4,6,9-10,13H2,(H2,26,31)(H,27,29)