N-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide Openeye Name: N-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide CAS Name: N-[5-[4-(2,5-dimethylphenyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxybenzamide IUPAC Name: N-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxybenzamide Traditional Name: N-[5-[4-(2,5-dimethylphenyl)piperazino]-1,3,4-thiadiazol-2-yl]-3,4,5-triethoxy-benzamide Formula: C27H35N5O4S MolecularWeight: 525.6629

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)N3CCN(CC3)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)N3CCN(CC3)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H35N5O4S/c1-6-34-22-16-20(17-23(35-7-2)24(22)36-8-3)25(33)28-26-29-30-27(37-26)32-13-11-31(12-14-32)21-15-18(4)9-10-19(21)5/h9-10,15-17H,6-8,11-14H2,1-5H3,(H,28,29,33)