3-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4,6-dimethyl-pyrimidin-5-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide

Systemtic Name: 3-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4,6-dimethyl-pyrimidin-5-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide Openeye Name: 3-[2-(2-amino-2-oxo-ethyl)sulfanyl-4,6-dimethyl-pyrimidin-5-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide CAS Name: 3-[2-[(2-amino-2-oxoethyl)thio]-4,6-dimethyl-5-pyrimidinyl]-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide IUPAC Name: 3-[2-(2-amino-2-oxoethyl)sulfanyl-4,6-dimethylpyrimidin-5-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide Traditional Name: 3-[2-[(2-amino-2-keto-ethyl)thio]-4,6-dimethyl-pyrimidin-5-yl]-N-(2-methyl-1,3-benzothiazol-6-yl)propionamide Formula: C19H21N5O2S2 MolecularWeight: 415.53234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC(=O)N)C)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)C

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC(=O)N)C)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)C

InChI

InChI=1S/C19H21N5O2S2/c1-10-14(11(2)22-19(21-10)27-9-17(20)25)5-7-18(26)24-13-4-6-15-16(8-13)28-12(3)23-15/h4,6,8H,5,7,9H2,1-3H3,(H2,20,25)(H,24,26)