2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-N-[1-(phenylmethyl)-3-propyl-pyrazol-4-yl]benzamide; methanamide

Systemtic Name: 2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-N-[1-(phenylmethyl)-3-propyl-pyrazol-4-yl]benzamide; methanamide Openeye Name: N-(1-benzyl-3-propyl-pyrazol-4-yl)-2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-benzamide; formamide CAS Name: 2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]-N-[1-(phenylmethyl)-3-propyl-4-pyrazolyl]benzamide; formamide IUPAC Name: N-(1-benzyl-3-propylpyrazol-4-yl)-2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzamide; formamide Traditional Name: N-(1-benzyl-3-propyl-pyrazol-4-yl)-2-ethoxy-5-(4-methylpiperazino)sulfonyl-benzamide; formamide Formula: C28H38N6O5S MolecularWeight: 570.70352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C)OCC)CC4=CC=CC=C4.C(=O)N

Isomeric SMILES

CCCC1=NN(C=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C)OCC)CC4=CC=CC=C4.C(=O)N

InChI

InChI=1S/C27H35N5O4S.CH3NO/c1-4-9-24-25(20-31(29-24)19-21-10-7-6-8-11-21)28-27(33)23-18-22(12-13-26(23)36-5-2)37(34,35)32-16-14-30(3)15-17-32;2-1-3/h6-8,10-13,18,20H,4-5,9,14-17,19H2,1-3H3,(H,28,33);1H,(H2,2,3)