3-propoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-propoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3-propoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 3-propoxy-N-[[3-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-propoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3-propoxy-N-[(3-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)N3CCCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)N3CCCC3

InChI

InChI=1S/C21H25N3O2S/c1-2-13-26-19-10-5-7-16(14-19)20(25)23-21(27)22-17-8-6-9-18(15-17)24-11-3-4-12-24/h5-10,14-15H,2-4,11-13H2,1H3,(H2,22,23,25,27)