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

Systemtic Name: N-(3,5-dimethoxyphenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Openeye Name: N-(3,5-dimethoxyphenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-1-[5-(4-ethyl-1-piperazinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-(3,5-dimethoxyphenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Traditional Name: N-(3,5-dimethoxyphenyl)-1-[5-(4-ethylpiperazino)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Formula: C21H26N6O3S MolecularWeight: 442.53454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NC4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NC4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C21H26N6O3S/c1-4-25-8-10-26(11-9-25)20-23-24-21(31-20)27-7-5-6-18(27)19(28)22-15-12-16(29-2)14-17(13-15)30-3/h5-7,12-14H,4,8-11H2,1-3H3,(H,22,28)