2-[6-(2-azanyl-2-oxidanylidene-ethyl)-4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)carbonyl-piperazin-2-yl]ethanamide

Systemtic Name: 2-[6-(2-azanyl-2-oxidanylidene-ethyl)-4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)carbonyl-piperazin-2-yl]ethanamide Openeye Name: 2-[6-(2-amino-2-oxo-ethyl)-4-[(6-chloro-2-naphthyl)sulfonyl]-1-[5-(4-pyridyl)pyrimidine-2-carbonyl]piperazin-2-yl]acetamide CAS Name: 2-[6-(2-amino-2-oxoethyl)-4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[oxo-(5-pyridin-4-yl-2-pyrimidinyl)methyl]-2-piperazinyl]acetamide IUPAC Name: 2-[6-(2-amino-2-oxoethyl)-4-(6-chloronaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidine-2-carbonyl)piperazin-2-yl]acetamide Traditional Name: 2-[6-(2-amino-2-keto-ethyl)-4-[(6-chloro-2-naphthyl)sulfonyl]-1-[5-(4-pyridyl)pyrimidine-2-carbonyl]piperazin-2-yl]acetamide Formula: C28H26ClN7O5S MolecularWeight: 608.06794

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC(=O)N)C(=O)C4=NC=C(C=N4)C5=CC=NC=C5)CC(=O)N

Isomeric SMILES

C1C(N(C(CN1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)CC(=O)N)C(=O)C4=NC=C(C=N4)C5=CC=NC=C5)CC(=O)N

InChI

InChI=1S/C28H26ClN7O5S/c29-21-3-1-19-10-24(4-2-18(19)9-21)42(40,41)35-15-22(11-25(30)37)36(23(16-35)12-26(31)38)28(39)27-33-13-20(14-34-27)17-5-7-32-8-6-17/h1-10,13-14,22-23H,11-12,15-16H2,(H2,30,37)(H2,31,38)