N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide Openeye Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(3-thienylmethyl)piperazine-1-carboxamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]-4-(3-thiophenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(thiophen-3-ylmethyl)piperazine-1-carboxamide Traditional Name: N-[4-[(1-methylimidazol-2-yl)thio]phenyl]-4-(3-thenyl)piperazine-1-carboxamide Formula: C20H23N5OS2 MolecularWeight: 413.55952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

CN1C=CN=C1SC2=CC=C(C=C2)NC(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C20H23N5OS2/c1-23-8-7-21-20(23)28-18-4-2-17(3-5-18)22-19(26)25-11-9-24(10-12-25)14-16-6-13-27-15-16/h2-8,13,15H,9-12,14H2,1H3,(H,22,26)