2-(2-chloranylpropanoylamino)-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 2-(2-chloranylpropanoylamino)-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 2-(2-chloropropanoylamino)-3-methyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 2-[(2-chloro-1-oxopropyl)amino]-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 2-(2-chloropropanoylamino)-3-methyl-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 2-(2-chloropropanoylamino)-3-methyl-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C17H21ClN4O2S MolecularWeight: 380.89224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C(C)C)NC(=O)C(C)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C(C)C)NC(=O)C(C)Cl

InChI

InChI=1S/C17H21ClN4O2S/c1-9(2)13(19-14(23)11(4)18)15(24)20-17-22-21-16(25-17)12-7-5-6-10(3)8-12/h5-9,11,13H,1-4H3,(H,19,23)(H,20,22,24)