N-[[4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[[4-(2-oxochromen-3-yl)phenyl]carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[4-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[4-(2-oxochromen-3-yl)phenyl]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[[4-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]-3-phenyl-propionamide Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=C(C=C2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC=C(C=C2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C25H20N2O3S/c28-23(15-10-17-6-2-1-3-7-17)27-25(31)26-20-13-11-18(12-14-20)21-16-19-8-4-5-9-22(19)30-24(21)29/h1-9,11-14,16H,10,15H2,(H2,26,27,28,31)