6-azanyl-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 5-allyl-6-amino-5-(1-methylbutyl)-2-thioxo-pyrimidin-4-one CAS Name: 6-amino-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 6-amino-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidenepyrimidin-4-one Traditional Name: 5-allyl-6-amino-5-(1-methylbutyl)-2-thioxo-pyrimidin-4-one Formula: C12H19N3OS MolecularWeight: 253.36376

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=NC(=S)NC1=O)N)CC=C

Isomeric SMILES

CCCC(C)C1(C(=NC(=S)NC1=O)N)CC=C

InChI

InChI=1S/C12H19N3OS/c1-4-6-8(3)12(7-5-2)9(13)14-11(17)15-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H3,13,14,15,16,17)