(5-morpholin-4-yl-4-phenyl-thiophen-2-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-morpholin-4-yl-4-phenyl-thiophen-2-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (5-morpholino-4-phenyl-2-thienyl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [5-(4-morpholinyl)-4-phenyl-2-thiophenyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (5-morpholin-4-yl-4-phenylthiophen-2-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (5-morpholino-4-phenyl-2-thienyl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C24H27N4O2S+ MolecularWeight: 435.56178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=C(S3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=C(S3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C24H26N4O2S/c29-23(27-12-10-26(11-13-27)22-8-4-5-9-25-22)21-18-20(19-6-2-1-3-7-19)24(31-21)28-14-16-30-17-15-28/h1-9,18H,10-17H2/p+1