N-ethyl-2-[4-(3-phenothiazin-10-ylpropanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-ethyl-2-[4-(3-phenothiazin-10-ylpropanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-ethyl-2-[4-(3-phenothiazin-10-ylpropanoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-ethyl-2-[4-[1-oxo-3-(10-phenothiazinyl)propyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-ethyl-2-[4-(3-phenothiazin-10-ylpropanoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-ethyl-2-[4-(3-phenothiazin-10-ylpropanoyl)piperazin-1-ium-1-yl]acetamide Formula: C23H29N4O2S+ MolecularWeight: 425.56696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+]1CCN(CC1)C(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CCNC(=O)C[NH+]1CCN(CC1)C(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C23H28N4O2S/c1-2-24-22(28)17-25-13-15-26(16-14-25)23(29)11-12-27-18-7-3-5-9-20(18)30-21-10-6-4-8-19(21)27/h3-10H,2,11-17H2,1H3,(H,24,28)/p+1