4-azanylidene-1-(furan-2-ylmethyl)-3-phenyl-5-(phenylsulfonyl)pyrimidin-2-one

Systemtic Name: 4-azanylidene-1-(furan-2-ylmethyl)-3-phenyl-5-(phenylsulfonyl)pyrimidin-2-one Openeye Name: 5-(benzenesulfonyl)-1-(2-furylmethyl)-4-imino-3-phenyl-pyrimidin-2-one CAS Name: 5-(benzenesulfonyl)-1-(2-furanylmethyl)-4-imino-3-phenyl-2-pyrimidinone IUPAC Name: 5-(benzenesulfonyl)-1-(furan-2-ylmethyl)-4-imino-3-phenylpyrimidin-2-one Traditional Name: 5-besyl-1-(2-furfuryl)-4-imino-3-phenyl-pyrimidin-2-one Formula: C21H17N3O4S MolecularWeight: 407.44238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=N)C(=CN(C2=O)CC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=N)C(=CN(C2=O)CC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O4S/c22-20-19(29(26,27)18-11-5-2-6-12-18)15-23(14-17-10-7-13-28-17)21(25)24(20)16-8-3-1-4-9-16/h1-13,15,22H,14H2