2-methyl-N-[5-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]-1,3-benzothiazol-2-yl]propanamide

Systemtic Name: 2-methyl-N-[5-[2-(4-methylpyrimidin-2-yl)sulfanylethanoylamino]-1,3-benzothiazol-2-yl]propanamide Openeye Name: 2-methyl-N-[5-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]-1,3-benzothiazol-2-yl]propanamide CAS Name: 2-methyl-N-[5-[[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]propanamide IUPAC Name: 2-methyl-N-[5-[[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]amino]-1,3-benzothiazol-2-yl]propanamide Traditional Name: 2-methyl-N-[5-[[2-[(4-methylpyrimidin-2-yl)thio]acetyl]amino]-1,3-benzothiazol-2-yl]propionamide Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C(C)C

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C(C)C

InChI

InChI=1S/C18H19N5O2S2/c1-10(2)16(25)23-18-22-13-8-12(4-5-14(13)27-18)21-15(24)9-26-17-19-7-6-11(3)20-17/h4-8,10H,9H2,1-3H3,(H,21,24)(H,22,23,25)