3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]propionamide Formula: C19H26N4O3S3 MolecularWeight: 454.62974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H26N4O3S3/c1-13-16(14(2)22-19(21-13)27-3)7-8-17(24)20-12-15-6-9-18(28-15)29(25,26)23-10-4-5-11-23/h6,9H,4-5,7-8,10-12H2,1-3H3,(H,20,24)