1-ethyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]pyrazole-3-carboxamide Openeye Name: 1-ethyl-N-[3-(2-furylmethylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]pyrazole-3-carboxamide CAS Name: 1-ethyl-N-[3-[(2-furanylmethylamino)-oxomethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]pyrazole-3-carboxamide Traditional Name: 1-ethyl-N-[3-(2-furfurylcarbamoyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]pyrazole-3-carboxamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CCN1C=CC(=N1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H24N4O3S/c1-2-25-11-10-16(24-25)19(26)23-21-18(15-8-4-3-5-9-17(15)29-21)20(27)22-13-14-7-6-12-28-14/h6-7,10-12H,2-5,8-9,13H2,1H3,(H,22,27)(H,23,26)