4-propan-2-yloxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 4-propan-2-yloxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 4-isopropoxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide CAS Name: 4-propan-2-yloxy-N-[[4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-propan-2-yloxy-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-isopropoxy-N-[(4-pyrrolidinophenyl)thiocarbamoyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCC3

InChI

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