4-phenyl-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidine-5-carbothialdehyde

Systemtic Name: 4-phenyl-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidine-5-carbothialdehyde Openeye Name: 4-phenyl-2-(3,4,5-trimethoxyanilino)pyrimidine-5-carbothialdehyde CAS Name: 4-phenyl-2-(3,4,5-trimethoxyanilino)-5-pyrimidinecarbothioaldehyde IUPAC Name: 4-phenyl-2-(3,4,5-trimethoxyanilino)pyrimidine-5-carbothialdehyde Traditional Name: 4-phenyl-2-(3,4,5-trimethoxyanilino)pyrimidine-5-carbothialdehyde Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=C(C(=N2)C3=CC=CC=C3)C=S

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=C(C(=N2)C3=CC=CC=C3)C=S

InChI

InChI=1S/C20H19N3O3S/c1-24-16-9-15(10-17(25-2)19(16)26-3)22-20-21-11-14(12-27)18(23-20)13-7-5-4-6-8-13/h4-12H,1-3H3,(H,21,22,23)