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N-(2-methoxyphenyl)-2-[5-methyl-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

N-(2-methoxyphenyl)-2-[5-methyl-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name:N-(2-methoxyphenyl)-2-[5-methyl-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide
Openeye Name:N-(2-methoxyphenyl)-2-[5-methyl-6-(4-methylpiperazin-4-ium-1-carbonyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetamide
CAS Name:N-(2-methoxyphenyl)-2-[5-methyl-6-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide
IUPAC Name:N-(2-methoxyphenyl)-2-[5-methyl-6-(4-methylpiperazin-4-ium-1-carbonyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide
Traditional Name:2-[4-keto-5-methyl-6-(4-methylpiperazin-4-ium-1-carbonyl)thieno[2,3-d]pyrimidin-3-yl]-N-(2-methoxyphenyl)acetamide
Formula: C22H26N5O4S+
MolecularWeight: 456.53794
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=CC=C3OC)C(=O)N4CC[NH+](CC4)C


Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=CC=C3OC)C(=O)N4CC[NH+](CC4)C


InChI

InChI=1S/C22H25N5O4S/c1-14-18-20(32-19(14)22(30)26-10-8-25(2)9-11-26)23-13-27(21(18)29)12-17(28)24-15-6-4-5-7-16(15)31-3/h4-7,13H,8-12H2,1-3H3,(H,24,28)/p+1


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Name: N-(2-methoxyphenyl)-2-[5-methyl-6-(4-methylpiperazin-4-ium-1-yl)carbonyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

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