N-(3,4-dimethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[(6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)SC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-14(21(25)24-16-9-10-18(26-2)19(11-16)27-3)28-20-12-17(22-13-23-20)15-7-5-4-6-8-15/h4-14H,1-3H3,(H,24,25)