N-(2-carbamothioyl-4-oxidanylidene-chromen-8-yl)-4-(8-phenyloctoxy)benzamide

Systemtic Name: N-(2-carbamothioyl-4-oxidanylidene-chromen-8-yl)-4-(8-phenyloctoxy)benzamide Openeye Name: N-(2-carbamothioyl-4-oxo-chromen-8-yl)-4-(8-phenyloctoxy)benzamide CAS Name: N-(2-carbamothioyl-4-oxo-1-benzopyran-8-yl)-4-(8-phenyloctoxy)benzamide IUPAC Name: N-(2-carbamothioyl-4-oxochromen-8-yl)-4-(8-phenyloctoxy)benzamide Traditional Name: N-(4-keto-2-thiocarbamoyl-chromen-8-yl)-4-(8-phenyloctoxy)benzamide Formula: C31H32N2O4S MolecularWeight: 528.66178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCOC2=CC=C(C=C2)C(=O)NC3=CC=CC4=C3OC(=CC4=O)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCOC2=CC=C(C=C2)C(=O)NC3=CC=CC4=C3OC(=CC4=O)C(=S)N

InChI

InChI=1S/C31H32N2O4S/c32-30(38)28-21-27(34)25-14-10-15-26(29(25)37-28)33-31(35)23-16-18-24(19-17-23)36-20-9-4-2-1-3-6-11-22-12-7-5-8-13-22/h5,7-8,10,12-19,21H,1-4,6,9,11,20H2,(H2,32,38)(H,33,35)