6-azanyl-2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[(3-ketobenzo[f]chromen-1-yl)methylthio]-1H-pyrimidin-4-one Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)CSC4=NC(=O)C=C(N4)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)CSC4=NC(=O)C=C(N4)N

InChI

InChI=1S/C18H13N3O3S/c19-14-8-15(22)21-18(20-14)25-9-11-7-16(23)24-13-6-5-10-3-1-2-4-12(10)17(11)13/h1-8H,9H2,(H3,19,20,21,22)