N-[1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[1-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(benzothiophen-3-ylmethyl)piperazino]-2-keto-1-methyl-ethyl]thiophene-2-carboxamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CSC3=CC=CC=C32)NC(=O)C4=CC=CS4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CSC3=CC=CC=C32)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H23N3O2S2/c1-15(22-20(25)19-7-4-12-27-19)21(26)24-10-8-23(9-11-24)13-16-14-28-18-6-3-2-5-17(16)18/h2-7,12,14-15H,8-11,13H2,1H3,(H,22,25)