[5-[5-[(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-4-piperazin-1-yl-pyridin-3-yl]-1H-pyrimidin-2-ylidene]methanone

Systemtic Name: [5-[5-[(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-4-piperazin-1-yl-pyridin-3-yl]-1H-pyrimidin-2-ylidene]methanone Openeye Name: [5-[5-[(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-4-piperazin-1-yl-3-pyridyl]-1H-pyrimidin-2-ylidene]methanone CAS Name: [5-[5-[(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-4-(1-piperazinyl)-3-pyridinyl]-1H-pyrimidin-2-ylidene]methanone IUPAC Name: [5-[5-[(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-4-piperazin-1-ylpyridin-3-yl]-1H-pyrimidin-2-ylidene]methanone Traditional Name: [5-[5-[(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-methyl-4-piperazino-3-pyridyl]-1H-pyrimidin-2-ylidene]methanone Formula: C24H25ClN6O3S MolecularWeight: 513.0117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1C2=CNC(=C=O)N=C2)N3CCNCC3)S(=O)(=O)N4CCC5=C(C4)C=CC=C5Cl

Isomeric SMILES

CC1=NC=C(C(=C1C2=CNC(=C=O)N=C2)N3CCNCC3)S(=O)(=O)N4CCC5=C(C4)C=CC=C5Cl

InChI

InChI=1S/C24H25ClN6O3S/c1-16-23(18-11-28-22(15-32)29-12-18)24(30-9-6-26-7-10-30)21(13-27-16)35(33,34)31-8-5-19-17(14-31)3-2-4-20(19)25/h2-4,11-13,26,28H,5-10,14H2,1H3