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

Systemtic Name: 2-(3-cyclopentylpropanoylamino)-3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 2-(3-cyclopentylpropanoylamino)-3-methyl-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 2-[(3-cyclopentyl-1-oxopropyl)amino]-3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 2-(3-cyclopentylpropanoylamino)-3-methyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 2-(3-cyclopentylpropanoylamino)-3-methyl-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(C(C)C)NC(=O)CCC3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(C(C)C)NC(=O)CCC3CCCC3

InChI

InChI=1S/C22H30N4O2S/c1-14(2)19(23-18(27)13-10-16-6-4-5-7-16)20(28)24-22-26-25-21(29-22)17-11-8-15(3)9-12-17/h8-9,11-12,14,16,19H,4-7,10,13H2,1-3H3,(H,23,27)(H,24,26,28)