[1-[(E)-butan-2-ylideneamino]-4-phenyl-2-sulfanylidene-pyrimidin-5-yl]-phenyl-methanone

Systemtic Name: [1-[(E)-butan-2-ylideneamino]-4-phenyl-2-sulfanylidene-pyrimidin-5-yl]-phenyl-methanone Openeye Name: [1-[(E)-1-methylpropylideneamino]-4-phenyl-2-thioxo-pyrimidin-5-yl]-phenyl-methanone CAS Name: [1-[(E)-butan-2-ylideneamino]-4-phenyl-2-sulfanylidene-5-pyrimidinyl]-phenylmethanone IUPAC Name: [1-[(E)-butan-2-ylideneamino]-4-phenyl-2-sulfanylidenepyrimidin-5-yl]-phenylmethanone Traditional Name: [1-[(E)-1-methylpropylideneamino]-4-phenyl-2-thioxo-pyrimidin-5-yl]-phenyl-methanone Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NN1C=C(C(=NC1=S)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC/C(=N/N1C=C(C(=NC1=S)C2=CC=CC=C2)C(=O)C3=CC=CC=C3)/C

InChI

InChI=1S/C21H19N3OS/c1-3-15(2)23-24-14-18(20(25)17-12-8-5-9-13-17)19(22-21(24)26)16-10-6-4-7-11-16/h4-14H,3H2,1-2H3/b23-15+