(4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanylethanoate; propane

Systemtic Name: (4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(6-azanyl-4-oxidanylidene-1-prop-2-enyl-pyrimidin-2-yl)sulfanylethanoate; propane Openeye Name: (4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(1-allyl-6-amino-4-oxo-pyrimidin-2-yl)sulfanylacetate; propane CAS Name: 2-[(6-amino-4-oxo-1-prop-2-enyl-2-pyrimidinyl)thio]acetic acid (4-methyl-3-bicyclo[2.2.0]hexanyl) ester; propane IUPAC Name: (4-methyl-3-bicyclo[2.2.0]hexanyl) 2-(6-amino-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanylacetate; propane Traditional Name: 2-[(1-allyl-6-amino-4-keto-pyrimidin-2-yl)thio]acetic acid (4-methyl-3-bicyclo[2.2.0]hexanyl) ester; n-propane Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CC12CCC1CC2OC(=O)CSC3=NC(=O)C=C(N3CC=C)N

Isomeric SMILES

CCC.CC12CCC1CC2OC(=O)CSC3=NC(=O)C=C(N3CC=C)N

InChI

InChI=1S/C16H21N3O3S.C3H8/c1-3-6-19-12(17)8-13(20)18-15(19)23-9-14(21)22-11-7-10-4-5-16(10,11)2;1-3-2/h3,8,10-11H,1,4-7,9,17H2,2H3;3H2,1-2H3