2-cyano-3-(8-methyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxidanylidene-N-(phenylmethyl)propanamide

Systemtic Name: 2-cyano-3-(8-methyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxidanylidene-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-cyano-3-(8-methyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxo-propanamide CAS Name: 2-cyano-3-(8-methyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxo-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-cyano-3-(8-methyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-3-oxopropanamide Traditional Name: N-benzyl-2-cyano-3-keto-3-(8-methyl-1-phenyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)propionamide Formula: C28H22N4O2S MolecularWeight: 478.56488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)C(C#N)C(=O)NCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)C(C#N)C(=O)NCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O2S/c1-18-12-13-24-21(14-18)26-23(17-35-24)25(31-32(26)20-10-6-3-7-11-20)27(33)22(15-29)28(34)30-16-19-8-4-2-5-9-19/h2-14,22H,16-17H2,1H3,(H,30,34)