N-(2,5-dimethylphenyl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide CAS Name: N-(2,5-dimethylphenyl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide IUPAC Name: N-(2,5-dimethylphenyl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Formula: C21H21N3OS MolecularWeight: 363.47594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)NC4=C(C=CC(=C4)C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)NC4=C(C=CC(=C4)C)C)C

InChI

InChI=1S/C21H21N3OS/c1-12-6-8-18-15(9-12)20-16(11-26-18)19(23-24(20)4)21(25)22-17-10-13(2)5-7-14(17)3/h5-10H,11H2,1-4H3,(H,22,25)