(2S)-N-butyl-4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazine-1-carboxamide

Systemtic Name: (2S)-N-butyl-4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazine-1-carboxamide Openeye Name: (2S)-N-butyl-4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-piperazine-1-carboxamide CAS Name: (2S)-N-butyl-4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-1-piperazinecarboxamide IUPAC Name: (2S)-N-butyl-4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methylpiperazine-1-carboxamide Traditional Name: (2S)-N-butyl-4-(3-m-anisyl-1,2,4-thiadiazol-5-yl)-2-methyl-piperazine-1-carboxamide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1C)C2=NC(=NS2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCNC(=O)N1CCN(C[C@@H]1C)C2=NC(=NS2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H29N5O2S/c1-4-5-9-21-19(26)25-11-10-24(14-15(25)2)20-22-18(23-28-20)13-16-7-6-8-17(12-16)27-3/h6-8,12,15H,4-5,9-11,13-14H2,1-3H3,(H,21,26)/t15-/m0/s1