2-(4-ethoxycarbonyl-1,3-thiazol-2-yl)ethyl-[1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: 2-(4-ethoxycarbonyl-1,3-thiazol-2-yl)ethyl-[1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phenyl]piperidin-4-yl]azanium Openeye Name: 2-(4-ethoxycarbonylthiazol-2-yl)ethyl-[1-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)phenyl]-4-piperidyl]ammonium CAS Name: 2-(4-ethoxycarbonyl-2-thiazolyl)ethyl-[1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]phenyl]-4-piperidinyl]ammonium IUPAC Name: 2-(4-ethoxycarbonyl-1,3-thiazol-2-yl)ethyl-[1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)phenyl]piperidin-4-yl]azanium Traditional Name: 2-(4-carbethoxythiazol-2-yl)ethyl-[1-[4-(2-keto-2-pyrrolidino-ethyl)phenyl]-4-piperidyl]ammonium Formula: C25H35N4O3S+ MolecularWeight: 471.6354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CC[NH2+]C2CCN(CC2)C3=CC=C(C=C3)CC(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CC[NH2+]C2CCN(CC2)C3=CC=C(C=C3)CC(=O)N4CCCC4

InChI

InChI=1S/C25H34N4O3S/c1-2-32-25(31)22-18-33-23(27-22)9-12-26-20-10-15-28(16-11-20)21-7-5-19(6-8-21)17-24(30)29-13-3-4-14-29/h5-8,18,20,26H,2-4,9-17H2,1H3/p+1