6-azanyl-5-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 5-[2-(1-allylbenzimidazol-2-yl)sulfanylacetyl]-6-amino-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[1-oxo-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]ethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylacetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 5-[2-[(1-allylbenzimidazol-2-yl)thio]acetyl]-6-amino-1-propyl-pyrimidine-2,4-quinone Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)CSC2=NC3=CC=CC=C3N2CC=C)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)CSC2=NC3=CC=CC=C3N2CC=C)N

InChI

InChI=1S/C19H21N5O3S/c1-3-9-23-13-8-6-5-7-12(13)21-19(23)28-11-14(25)15-16(20)24(10-4-2)18(27)22-17(15)26/h3,5-8H,1,4,9-11,20H2,2H3,(H,22,26,27)