[5-[5-(6-chloranylnaphthalen-2-yl)sulfonyl-4-methyl-3-piperazin-1-yl-pyridin-2-yl]-1H-pyrimidin-2-ylidene]methanone

Systemtic Name: [5-[5-(6-chloranylnaphthalen-2-yl)sulfonyl-4-methyl-3-piperazin-1-yl-pyridin-2-yl]-1H-pyrimidin-2-ylidene]methanone Openeye Name: [5-[5-[(6-chloro-2-naphthyl)sulfonyl]-4-methyl-3-piperazin-1-yl-2-pyridyl]-1H-pyrimidin-2-ylidene]methanone CAS Name: [5-[5-[(6-chloro-2-naphthalenyl)sulfonyl]-4-methyl-3-(1-piperazinyl)-2-pyridinyl]-1H-pyrimidin-2-ylidene]methanone IUPAC Name: [5-[5-(6-chloronaphthalen-2-yl)sulfonyl-4-methyl-3-piperazin-1-ylpyridin-2-yl]-1H-pyrimidin-2-ylidene]methanone Traditional Name: [5-[5-[(6-chloro-2-naphthyl)sulfonyl]-4-methyl-3-piperazino-2-pyridyl]-1H-pyrimidin-2-ylidene]methanone Formula: C25H22ClN5O3S MolecularWeight: 507.99188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CNC(=C=O)N=C4)N5CCNCC5

Isomeric SMILES

CC1=C(C(=NC=C1S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl)C4=CNC(=C=O)N=C4)N5CCNCC5

InChI

InChI=1S/C25H22ClN5O3S/c1-16-22(35(33,34)21-5-3-17-10-20(26)4-2-18(17)11-21)14-30-24(19-12-28-23(15-32)29-13-19)25(16)31-8-6-27-7-9-31/h2-5,10-14,27-28H,6-9H2,1H3