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

Systemtic Name: (2R)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2R)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: (2R)-2-[(6-oxo-1H-pyrimidin-2-yl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: (2R)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2R)-2-[(6-keto-1H-pyrimidin-2-yl)thio]-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C17H20N4O4S2 MolecularWeight: 408.4951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SC3=NC=CC(=O)N3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)SC3=NC=CC(=O)N3

InChI

InChI=1S/C17H20N4O4S2/c1-12(26-17-18-9-8-15(22)20-17)16(23)19-13-4-6-14(7-5-13)27(24,25)21-10-2-3-11-21/h4-9,12H,2-3,10-11H2,1H3,(H,19,23)(H,18,20,22)/t12-/m1/s1