3-(diethylamino)propyl 3-(2-cyano-3-oxidanylidene-3-phenylazanyl-propanoyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylate

Systemtic Name: 3-(diethylamino)propyl 3-(2-cyano-3-oxidanylidene-3-phenylazanyl-propanoyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylate Openeye Name: 3-(diethylamino)propyl 3-(3-anilino-2-cyano-3-oxo-propanoyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylate CAS Name: 3-(3-anilino-2-cyano-1,3-dioxopropyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid 3-(diethylamino)propyl ester IUPAC Name: 3-(diethylamino)propyl 3-(3-anilino-2-cyano-3-oxopropanoyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylate Traditional Name: 3-(3-anilino-2-cyano-3-keto-propanoyl)-1-phenyl-4H-thiochromeno[4,3-c]pyrazole-8-carboxylic acid 3-(diethylamino)propyl ester Formula: C34H33N5O4S MolecularWeight: 607.72192

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC(=O)C1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN(CC)CCCOC(=O)C1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H33N5O4S/c1-3-38(4-2)18-11-19-43-34(42)23-16-17-29-26(20-23)31-28(22-44-29)30(37-39(31)25-14-9-6-10-15-25)32(40)27(21-35)33(41)36-24-12-7-5-8-13-24/h5-10,12-17,20,27H,3-4,11,18-19,22H2,1-2H3,(H,36,41)