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

Systemtic Name: N-[(3-methoxyphenyl)methyl]-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Openeye Name: N-[(3-methoxyphenyl)methyl]-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-1-[5-(4-propyl-1-piperazinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-1-[5-(4-propylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Traditional Name: N-m-anisyl-1-[5-(4-propylpiperazino)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Formula: C22H28N6O2S MolecularWeight: 440.56172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N6O2S/c1-3-9-26-11-13-27(14-12-26)21-24-25-22(31-21)28-10-5-8-19(28)20(29)23-16-17-6-4-7-18(15-17)30-2/h4-8,10,15H,3,9,11-14,16H2,1-2H3,(H,23,29)