[4-[6-[(4-dimethylaminophenyl)-methyl-amino]-2-ethylsulfanyl-pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[6-[(4-dimethylaminophenyl)-methyl-amino]-2-ethylsulfanyl-pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[6-[4-(dimethylamino)-N-methyl-anilino]-2-ethylsulfanyl-pyrimidin-4-yl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[6-[4-(dimethylamino)-N-methylanilino]-2-(ethylthio)-4-pyrimidinyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[6-[4-(dimethylamino)-N-methylanilino]-2-ethylsulfanylpyrimidin-4-yl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[6-[4-(dimethylamino)-N-methyl-anilino]-2-(ethylthio)pyrimidin-4-yl]piperazino]-phenyl-methanone Formula: C26H32N6OS MolecularWeight: 476.63688

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=CC(=N1)N(C)C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCSC1=NC(=CC(=N1)N(C)C2=CC=C(C=C2)N(C)C)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H32N6OS/c1-5-34-26-27-23(30(4)22-13-11-21(12-14-22)29(2)3)19-24(28-26)31-15-17-32(18-16-31)25(33)20-9-7-6-8-10-20/h6-14,19H,5,15-18H2,1-4H3