3-(3-methylbutoxy)-N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-[(4-morpholin-4-ylcarbonylphenyl)carbamothioyl]benzamide Openeye Name: 3-isopentyloxy-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide CAS Name: 3-(3-methylbutoxy)-N-[[4-[4-morpholinyl(oxo)methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-[[4-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-isoamoxy-N-[[4-(morpholine-4-carbonyl)phenyl]thiocarbamoyl]benzamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCOCC3

InChI

InChI=1S/C24H29N3O4S/c1-17(2)10-13-31-21-5-3-4-19(16-21)22(28)26-24(32)25-20-8-6-18(7-9-20)23(29)27-11-14-30-15-12-27/h3-9,16-17H,10-15H2,1-2H3,(H2,25,26,28,32)