3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC)C

InChI

InChI=1S/C17H18N4O2S2/c1-10-8-11(2)19-16(18-10)24-7-6-15(22)21-17-20-13-5-4-12(23-3)9-14(13)25-17/h4-5,8-9H,6-7H2,1-3H3,(H,20,21,22)