N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[(4-isopentyloxyphenyl)carbamothioyl]-3-phenyl-propanamide CAS Name: N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-3-phenylpropanamide Traditional Name: N-[(4-isoamoxyphenyl)thiocarbamoyl]-3-phenyl-propionamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-16(2)14-15-25-19-11-9-18(10-12-19)22-21(26)23-20(24)13-8-17-6-4-3-5-7-17/h3-7,9-12,16H,8,13-15H2,1-2H3,(H2,22,23,24,26)