N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-4-oxo-2-phenyl-chromene-8-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-4-oxo-2-phenylchromene-8-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-keto-3-methyl-2-phenyl-chromene-8-carboxamide Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCCSCC3=CC=CC=C3C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCCSCC3=CC=CC=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C27H22N2O3S/c1-18-24(30)22-12-7-13-23(26(22)32-25(18)19-8-3-2-4-9-19)27(31)29-14-15-33-17-21-11-6-5-10-20(21)16-28/h2-13H,14-15,17H2,1H3,(H,29,31)