N-[3-(3-methylbutanoylamino)propyl]-1-phenyl-3-propan-2-yl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[3-(3-methylbutanoylamino)propyl]-1-phenyl-3-propan-2-yl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-isopropyl-N-[3-(3-methylbutanoylamino)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[3-[(3-methyl-1-oxobutyl)amino]propyl]-1-phenyl-3-propan-2-yl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-[3-(3-methylbutanoylamino)propyl]-1-phenyl-3-propan-2-ylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 3-isopropyl-N-[3-(isovalerylamino)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NCCCNC(=O)C1=CC2=C(S1)N(N=C2C(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)NCCCNC(=O)C1=CC2=C(S1)N(N=C2C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H30N4O2S/c1-15(2)13-20(28)24-11-8-12-25-22(29)19-14-18-21(16(3)4)26-27(23(18)30-19)17-9-6-5-7-10-17/h5-7,9-10,14-16H,8,11-13H2,1-4H3,(H,24,28)(H,25,29)