1-(4-hexylphenyl)carbonyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-hexylphenyl)carbonyl-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-hexylbenzoyl)-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide CAS Name: 1-[(4-hexylphenyl)-oxomethyl]-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-hexylbenzoyl)-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(4-hexylbenzoyl)-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C27H32N4O2S MolecularWeight: 476.63358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H32N4O2S/c1-3-4-5-6-8-20-12-16-22(17-13-20)26(33)31-18-7-9-23(31)24(32)28-27-30-29-25(34-27)21-14-10-19(2)11-15-21/h10-17,23H,3-9,18H2,1-2H3,(H,28,30,32)