3-bromanyl-4-phenethyloxy-N-pyrrolidin-1-ylcarbothioyl-benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-pyrrolidin-1-ylcarbothioyl-benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-(pyrrolidine-1-carbothioyl)benzamide CAS Name: 3-bromo-4-phenethyloxy-N-[1-pyrrolidinyl(sulfanylidene)methyl]benzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-(pyrrolidine-1-carbothioyl)benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-(pyrrolidine-1-carbothioyl)benzamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

C1CCN(C1)C(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C20H21BrN2O2S/c21-17-14-16(19(24)22-20(26)23-11-4-5-12-23)8-9-18(17)25-13-10-15-6-2-1-3-7-15/h1-3,6-9,14H,4-5,10-13H2,(H,22,24,26)