2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-pyrrolidin-1-ylphenyl)methyleneamino]acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[(E)-[4-(1-pyrrolidinyl)phenyl]methylideneamino]acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-(4-pyrrolidin-1-ylphenyl)methylideneamino]acetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[(E)-(4-pyrrolidinobenzylidene)amino]acetamide Formula: C19H23N5OS MolecularWeight: 369.48382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC=C(C=C2)N3CCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N/N=C/C2=CC=C(C=C2)N3CCCC3)C

InChI

InChI=1S/C19H23N5OS/c1-14-11-15(2)22-19(21-14)26-13-18(25)23-20-12-16-5-7-17(8-6-16)24-9-3-4-10-24/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,23,25)/b20-12+