N-butyl-3-[1-(3-chlorophenyl)-4H-thiochromeno[4,3-c]pyrazol-3-yl]-2-cyano-3-oxidanylidene-propanamide

Systemtic Name: N-butyl-3-[1-(3-chlorophenyl)-4H-thiochromeno[4,3-c]pyrazol-3-yl]-2-cyano-3-oxidanylidene-propanamide Openeye Name: N-butyl-3-[1-(3-chlorophenyl)-4H-thiochromeno[4,3-c]pyrazol-3-yl]-2-cyano-3-oxo-propanamide CAS Name: N-butyl-3-[1-(3-chlorophenyl)-4H-thiochromeno[4,3-c]pyrazol-3-yl]-2-cyano-3-oxopropanamide IUPAC Name: N-butyl-3-[1-(3-chlorophenyl)-4H-thiochromeno[4,3-c]pyrazol-3-yl]-2-cyano-3-oxopropanamide Traditional Name: N-butyl-3-[1-(3-chlorophenyl)-4H-thiochromeno[4,3-c]pyrazol-3-yl]-2-cyano-3-keto-propionamide Formula: C24H21ClN4O2S MolecularWeight: 464.96714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C#N)C(=O)C1=NN(C2=C1CSC3=CC=CC=C32)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCCCNC(=O)C(C#N)C(=O)C1=NN(C2=C1CSC3=CC=CC=C32)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H21ClN4O2S/c1-2-3-11-27-24(31)18(13-26)23(30)21-19-14-32-20-10-5-4-9-17(20)22(19)29(28-21)16-8-6-7-15(25)12-16/h4-10,12,18H,2-3,11,14H2,1H3,(H,27,31)