4-azanyl-6-[1-[(4-fluorophenyl)methyl]azetidin-3-yl]imino-1,3-dimethyl-2-sulfanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-6-[1-[(4-fluorophenyl)methyl]azetidin-3-yl]imino-1,3-dimethyl-2-sulfanylidene-pyrimidine-5-carbonitrile Openeye Name: 4-amino-6-[1-[(4-fluorophenyl)methyl]azetidin-3-yl]imino-1,3-dimethyl-2-thioxo-pyrimidine-5-carbonitrile CAS Name: 4-amino-6-[[1-[(4-fluorophenyl)methyl]-3-azetidinyl]imino]-1,3-dimethyl-2-sulfanylidene-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-6-[1-[(4-fluorophenyl)methyl]azetidin-3-yl]imino-1,3-dimethyl-2-sulfanylidenepyrimidine-5-carbonitrile Traditional Name: 4-amino-6-[1-(4-fluorobenzyl)azetidin-3-yl]imino-1,3-dimethyl-2-thioxo-pyrimidine-5-carbonitrile Formula: C17H19FN6S MolecularWeight: 358.436363

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=NC2CN(C2)CC3=CC=C(C=C3)F)N(C1=S)C)C#N)N

Isomeric SMILES

CN1C(=C(C(=NC2CN(C2)CC3=CC=C(C=C3)F)N(C1=S)C)C#N)N

InChI

InChI=1S/C17H19FN6S/c1-22-15(20)14(7-19)16(23(2)17(22)25)21-13-9-24(10-13)8-11-3-5-12(18)6-4-11/h3-6,13H,8-10,20H2,1-2H3