N-[(4-methylphenyl)methyl]-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Openeye Name: 1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(p-tolylmethyl)pyrrole-2-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-[5-(4-propyl-1-piperazinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Traditional Name: N-(4-methylbenzyl)-1-[5-(4-propylpiperazino)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Formula: C22H28N6OS MolecularWeight: 424.56232

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NCC4=CC=C(C=C4)C

Isomeric SMILES

CCCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C22H28N6OS/c1-3-10-26-12-14-27(15-13-26)21-24-25-22(30-21)28-11-4-5-19(28)20(29)23-16-18-8-6-17(2)7-9-18/h4-9,11H,3,10,12-16H2,1-2H3,(H,23,29)