(2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]propionamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)S[C@H](C)C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H21N3O4S/c1-3-4-12-10-16(22)21-18(20-12)26-11(2)17(23)19-13-5-6-14-15(9-13)25-8-7-24-14/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,19,23)(H,20,21,22)/t11-/m1/s1