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

Systemtic Name: 1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(4-methylphenyl)methyl]pyrrole-2-carboxamide Openeye Name: 1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-(p-tolylmethyl)pyrrole-2-carboxamide CAS Name: 1-[5-(4-ethyl-1-piperazinyl)-1,3,4-thiadiazol-2-yl]-N-[(4-methylphenyl)methyl]-2-pyrrolecarboxamide IUPAC Name: 1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-N-[(4-methylphenyl)methyl]pyrrole-2-carboxamide Traditional Name: 1-[5-(4-ethylpiperazino)-1,3,4-thiadiazol-2-yl]-N-(4-methylbenzyl)pyrrole-2-carboxamide Formula: C21H26N6OS MolecularWeight: 410.53574

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NCC4=CC=C(C=C4)C

Isomeric SMILES

CCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C21H26N6OS/c1-3-25-11-13-26(14-12-25)20-23-24-21(29-20)27-10-4-5-18(27)19(28)22-15-17-8-6-16(2)7-9-17/h4-10H,3,11-15H2,1-2H3,(H,22,28)