N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CSC3=CC=CC=C32)C(=N1)C(=O)NCC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CN1C2=C(CSC3=CC=CC=C32)C(=N1)C(=O)NCC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C21H21N3O3S/c1-24-20-15-6-4-5-7-18(15)28-12-16(20)19(23-24)21(25)22-11-13-10-14(26-2)8-9-17(13)27-3/h4-10H,11-12H2,1-3H3,(H,22,25)