N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-3-methyl-1-(phenylmethyl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-3-methyl-1-(phenylmethyl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-benzyl-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-3-methyl-1-(phenylmethyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-benzyl-3-methylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-benzyl-3-methyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3CCN(CC3)CC(=O)N)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3CCN(CC3)CC(=O)N)CC4=CC=CC=C4

InChI

InChI=1S/C21H25N5O2S/c1-14-17-11-18(20(28)23-16-7-9-25(10-8-16)13-19(22)27)29-21(17)26(24-14)12-15-5-3-2-4-6-15/h2-6,11,16H,7-10,12-13H2,1H3,(H2,22,27)(H,23,28)