N-ethyl-3-(3-methoxyphenyl)-4-piperidin-1-ylcarbonyl-pyrrolidine-1-carbothioamide

Systemtic Name: N-ethyl-3-(3-methoxyphenyl)-4-piperidin-1-ylcarbonyl-pyrrolidine-1-carbothioamide Openeye Name: N-ethyl-3-(3-methoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidine-1-carbothioamide CAS Name: N-ethyl-3-(3-methoxyphenyl)-4-[oxo(1-piperidinyl)methyl]-1-pyrrolidinecarbothioamide IUPAC Name: N-ethyl-3-(3-methoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidine-1-carbothioamide Traditional Name: N-ethyl-3-(3-methoxyphenyl)-4-(piperidine-1-carbonyl)pyrrolidine-1-carbothioamide Formula: C20H29N3O2S MolecularWeight: 375.52816

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CC(C(C1)C(=O)N2CCCCC2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCNC(=S)N1CC(C(C1)C(=O)N2CCCCC2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H29N3O2S/c1-3-21-20(26)23-13-17(15-8-7-9-16(12-15)25-2)18(14-23)19(24)22-10-5-4-6-11-22/h7-9,12,17-18H,3-6,10-11,13-14H2,1-2H3,(H,21,26)