2-[6-(2-azanyl-2-oxidanylidene-ethyl)-4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)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)piperazin-2-yl]ethanamide Openeye Name: 2-[6-(2-amino-2-oxo-ethyl)-4-[(6-chloro-2-naphthyl)sulfonyl]-1-[5-(4-pyridyl)pyrimidin-2-yl]piperazin-2-yl]acetamide CAS Name: 2-[6-(2-amino-2-oxoethyl)-4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-(5-pyridin-4-yl-2-pyrimidinyl)-2-piperazinyl]acetamide IUPAC Name: 2-[6-(2-amino-2-oxoethyl)-4-(6-chloronaphthalen-2-yl)sulfonyl-1-(5-pyridin-4-ylpyrimidin-2-yl)piperazin-2-yl]acetamide Traditional Name: 2-[6-(2-amino-2-keto-ethyl)-4-[(6-chloro-2-naphthyl)sulfonyl]-1-[5-(4-pyridyl)pyrimidin-2-yl]piperazin-2-yl]acetamide Formula: C27H26ClN7O4S MolecularWeight: 580.05784

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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)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)C4=NC=C(C=N4)C5=CC=NC=C5)CC(=O)N

InChI

InChI=1S/C27H26ClN7O4S/c28-21-3-1-19-10-24(4-2-18(19)9-21)40(38,39)34-15-22(11-25(29)36)35(23(16-34)12-26(30)37)27-32-13-20(14-33-27)17-5-7-31-8-6-17/h1-10,13-14,22-23H,11-12,15-16H2,(H2,29,36)(H2,30,37)