ethyl 1-[(1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(1-methyl-4H-thiochromeno[4,3-c]pyrazol-3-yl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(1-methyl-4H-thiochromeno[4,3-c]pyrazole-3-carbonyl)isonipecotic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=NN(C3=C2CSC4=CC=CC=C43)C

InChI

InChI=1S/C20H23N3O3S/c1-3-26-20(25)13-8-10-23(11-9-13)19(24)17-15-12-27-16-7-5-4-6-14(16)18(15)22(2)21-17/h4-7,13H,3,8-12H2,1-2H3