N-[3-aminocarbonyl-5-ethyl-1-(pyridin-2-ylmethyl)pyrazol-4-yl]-5-(4-ethylpiperazin-1-yl)sulfonyl-2-(propylamino)pyridine-3-carboxamide

Systemtic Name: N-[3-aminocarbonyl-5-ethyl-1-(pyridin-2-ylmethyl)pyrazol-4-yl]-5-(4-ethylpiperazin-1-yl)sulfonyl-2-(propylamino)pyridine-3-carboxamide Openeye Name: N-[3-carbamoyl-5-ethyl-1-(2-pyridylmethyl)pyrazol-4-yl]-5-(4-ethylpiperazin-1-yl)sulfonyl-2-(propylamino)pyridine-3-carboxamide CAS Name: N-[3-carbamoyl-5-ethyl-1-(2-pyridinylmethyl)-4-pyrazolyl]-5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-(propylamino)-3-pyridinecarboxamide IUPAC Name: N-[3-carbamoyl-5-ethyl-1-(pyridin-2-ylmethyl)pyrazol-4-yl]-5-(4-ethylpiperazin-1-yl)sulfonyl-2-(propylamino)pyridine-3-carboxamide Traditional Name: N-[3-carbamoyl-5-ethyl-1-(2-pyridylmethyl)pyrazol-4-yl]-5-(4-ethylpiperazino)sulfonyl-2-(propylamino)nicotinamide Formula: C27H37N9O4S MolecularWeight: 583.70558

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=C(C=C1C(=O)NC2=C(N(N=C2C(=O)N)CC3=CC=CC=N3)CC)S(=O)(=O)N4CCN(CC4)CC

Isomeric SMILES

CCCNC1=NC=C(C=C1C(=O)NC2=C(N(N=C2C(=O)N)CC3=CC=CC=N3)CC)S(=O)(=O)N4CCN(CC4)CC

InChI

InChI=1S/C27H37N9O4S/c1-4-10-30-26-21(16-20(17-31-26)41(39,40)35-14-12-34(6-3)13-15-35)27(38)32-23-22(5-2)36(33-24(23)25(28)37)18-19-9-7-8-11-29-19/h7-9,11,16-17H,4-6,10,12-15,18H2,1-3H3,(H2,28,37)(H,30,31)(H,32,38)