N-(2-carbamothioyl-4-oxidanylidene-chromen-6-yl)-16-phenyl-hexadecanamide

Systemtic Name: N-(2-carbamothioyl-4-oxidanylidene-chromen-6-yl)-16-phenyl-hexadecanamide Openeye Name: N-(2-carbamothioyl-4-oxo-chromen-6-yl)-16-phenyl-hexadecanamide CAS Name: N-(2-carbamothioyl-4-oxo-1-benzopyran-6-yl)-16-phenylhexadecanamide IUPAC Name: N-(2-carbamothioyl-4-oxochromen-6-yl)-16-phenylhexadecanamide Traditional Name: N-(4-keto-2-thiocarbamoyl-chromen-6-yl)-16-phenyl-palmitamide Formula: C32H42N2O3S MolecularWeight: 534.75248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H42N2O3S/c33-32(38)30-24-28(35)27-23-26(21-22-29(27)37-30)34-31(36)20-16-11-9-7-5-3-1-2-4-6-8-10-13-17-25-18-14-12-15-19-25/h12,14-15,18-19,21-24H,1-11,13,16-17,20H2,(H2,33,38)(H,34,36)