(E)-3-(2,2-diphenylcyclopropyl)-N-(4-pyridin-3-ylbutyl)prop-2-enethioamide

Systemtic Name: (E)-3-(2,2-diphenylcyclopropyl)-N-(4-pyridin-3-ylbutyl)prop-2-enethioamide Openeye Name: (E)-3-(2,2-diphenylcyclopropyl)-N-[4-(3-pyridyl)butyl]prop-2-enethioamide CAS Name: (E)-3-(2,2-diphenylcyclopropyl)-N-[4-(3-pyridinyl)butyl]-2-propenethioamide IUPAC Name: (E)-3-(2,2-diphenylcyclopropyl)-N-(4-pyridin-3-ylbutyl)prop-2-enethioamide Traditional Name: (E)-3-(2,2-diphenylcyclopropyl)-N-[4-(3-pyridyl)butyl]thioacrylamide Formula: C27H28N2S MolecularWeight: 412.58962

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1(C2=CC=CC=C2)C3=CC=CC=C3)C=CC(=S)NCCCCC4=CN=CC=C4

Isomeric SMILES

C1C(C1(C2=CC=CC=C2)C3=CC=CC=C3)/C=C/C(=S)NCCCCC4=CN=CC=C4

InChI

InChI=1S/C27H28N2S/c30-26(29-19-8-7-10-22-11-9-18-28-21-22)17-16-25-20-27(25,23-12-3-1-4-13-23)24-14-5-2-6-15-24/h1-6,9,11-18,21,25H,7-8,10,19-20H2,(H,29,30)/b17-16+