N-(4-ethylphenyl)-2-methyl-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-ethylphenyl)-2-methyl-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-ethylphenyl)-2-methyl-piperazine-1-carboxamide CAS Name: N-(4-ethylphenyl)-2-methyl-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-ethylphenyl)-2-methylpiperazine-1-carboxamide Traditional Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(4-ethylphenyl)-2-methyl-piperazine-1-carboxamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2C)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2C)C3=NC(=NS3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5OS/c1-3-18-9-11-20(12-10-18)24-22(29)28-14-13-27(16-17(28)2)23-25-21(26-30-23)15-19-7-5-4-6-8-19/h4-12,17H,3,13-16H2,1-2H3,(H,24,29)