[2-[[4-(4-methylpiperidin-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-[(R)-phenyl(thiophen-2-yl)methyl]azanium

Systemtic Name: [2-[[4-(4-methylpiperidin-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-[(R)-phenyl(thiophen-2-yl)methyl]azanium Openeye Name: [2-[4-(4-methyl-1-piperidyl)anilino]-2-oxo-ethyl]-[(R)-phenyl(2-thienyl)methyl]ammonium CAS Name: [2-[4-(4-methyl-1-piperidinyl)anilino]-2-oxoethyl]-[(R)-phenyl(thiophen-2-yl)methyl]ammonium IUPAC Name: [2-[4-(4-methylpiperidin-1-yl)anilino]-2-oxoethyl]-[(R)-phenyl(thiophen-2-yl)methyl]azanium Traditional Name: [2-keto-2-[4-(4-methylpiperidino)anilino]ethyl]-[(R)-phenyl(2-thienyl)methyl]ammonium Formula: C25H30N3OS+ MolecularWeight: 420.5902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH2+]C(C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH2+][C@H](C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C25H29N3OS/c1-19-13-15-28(16-14-19)22-11-9-21(10-12-22)27-24(29)18-26-25(23-8-5-17-30-23)20-6-3-2-4-7-20/h2-12,17,19,25-26H,13-16,18H2,1H3,(H,27,29)/p+1/t25-/m1/s1