6-azanyl-1-(furan-2-ylmethyl)-2-(phenylmethylsulfanyl)pyrimidin-4-one

Systemtic Name: 6-azanyl-1-(furan-2-ylmethyl)-2-(phenylmethylsulfanyl)pyrimidin-4-one Openeye Name: 6-amino-2-benzylsulfanyl-1-(2-furylmethyl)pyrimidin-4-one CAS Name: 6-amino-1-(2-furanylmethyl)-2-(phenylmethylthio)-4-pyrimidinone IUPAC Name: 6-amino-2-benzylsulfanyl-1-(furan-2-ylmethyl)pyrimidin-4-one Traditional Name: 6-amino-2-(benzylthio)-1-(2-furfuryl)pyrimidin-4-one Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=O)C=C(N2CC3=CC=CO3)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=O)C=C(N2CC3=CC=CO3)N

InChI

InChI=1S/C16H15N3O2S/c17-14-9-15(20)18-16(19(14)10-13-7-4-8-21-13)22-11-12-5-2-1-3-6-12/h1-9H,10-11,17H2