2-(butanoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide

Systemtic Name: 2-(butanoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide Openeye Name: 2-(butanoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(1-oxobutylamino)pentanamide IUPAC Name: 2-(butanoylamino)-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide Traditional Name: 2-butyramido-N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-valeramide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C(C)CC)C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCC(=O)NC(C(C)CC)C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H29N5O2S/c1-6-8-16(26)21-17(13(3)7-2)18(27)22-20-24-23-19(28-20)14-9-11-15(12-10-14)25(4)5/h9-13,17H,6-8H2,1-5H3,(H,21,26)(H,22,24,27)