N-[2-[(1R)-1-cyclopropylethyl]pyrazol-3-yl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-[(1R)-1-cyclopropylethyl]pyrazol-3-yl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-[(1R)-1-cyclopropylethyl]pyrazol-3-yl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[2-[(1R)-1-cyclopropylethyl]-3-pyrazolyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-[(1R)-1-cyclopropylethyl]pyrazol-3-yl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-[2-[(1R)-1-cyclopropylethyl]pyrazol-3-yl]benzamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N2C(=CC=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

C[C@H](C1CC1)N2C(=CC=N2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C21H27N5O4S/c1-15(17-6-7-17)26-20(8-9-22-26)23-21(28)18-4-3-5-19(14-18)31(29,30)25-12-10-24(11-13-25)16(2)27/h3-5,8-9,14-15,17H,6-7,10-13H2,1-2H3,(H,23,28)/t15-/m1/s1