N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-3-methyl-1-(phenylmethyl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-3-methyl-1-(phenylmethyl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-benzyl-N-[2-(2-furylmethylamino)-2-oxo-ethyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-3-methyl-1-(phenylmethyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-3-methylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-benzyl-N-[2-(2-furfurylamino)-2-keto-ethyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NCC(=O)NCC3=CC=CO3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NCC(=O)NCC3=CC=CO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3S/c1-14-17-10-18(20(27)23-12-19(26)22-11-16-8-5-9-28-16)29-21(17)25(24-14)13-15-6-3-2-4-7-15/h2-10H,11-13H2,1H3,(H,22,26)(H,23,27)