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

Systemtic Name: N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Openeye Name: N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide CAS Name: N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide IUPAC Name: N-[2-(4-ethoxyphenyl)ethyl]-1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Traditional Name: 1-methyl-N-(2-p-phenetylethyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCNC(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CCNC(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C

InChI

InChI=1S/C22H23N3O2S/c1-3-27-16-10-8-15(9-11-16)12-13-23-22(26)20-18-14-28-19-7-5-4-6-17(19)21(18)25(2)24-20/h4-11H,3,12-14H2,1-2H3,(H,23,26)