N-[[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]thiophen-2-yl]methyl]propanamide

Systemtic Name: N-[[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]thiophen-2-yl]methyl]propanamide Openeye Name: N-[[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]-2-thienyl]methyl]propanamide CAS Name: N-[[5-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-1-oxobutyl]-2-thiophenyl]methyl]propanamide IUPAC Name: N-[[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]thiophen-2-yl]methyl]propanamide Traditional Name: N-[[5-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butanoyl]-2-thienyl]methyl]propionamide Formula: C23H28N4O2S2 MolecularWeight: 456.62402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC1=CC=C(S1)C(=O)CCCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCC(=O)NCC1=CC=C(S1)C(=O)CCCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C23H28N4O2S2/c1-2-22(29)24-16-17-9-10-21(30-17)19(28)7-5-11-26-12-14-27(15-13-26)23-18-6-3-4-8-20(18)31-25-23/h3-4,6,8-10H,2,5,7,11-16H2,1H3,(H,24,29)