(2R)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: (2R)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2R)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: (2R)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: (2R)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2R)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C20H26N4O4S2 MolecularWeight: 450.57484

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)S[C@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H26N4O4S2/c1-3-6-16-13-18(25)23-20(22-16)29-14(2)19(26)21-15-7-9-17(10-8-15)30(27,28)24-11-4-5-12-24/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,21,26)(H,22,23,25)/t14-/m1/s1