N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[(2-hydroxy-5-sec-butyl-phenyl)carbamothioyl]-4-isopropoxy-benzamide CAS Name: N-[(5-butan-2-yl-2-hydroxyanilino)-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: N-[(2-hydroxy-5-sec-butyl-phenyl)thiocarbamoyl]-4-isopropoxy-benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C

InChI

InChI=1S/C21H26N2O3S/c1-5-14(4)16-8-11-19(24)18(12-16)22-21(27)23-20(25)15-6-9-17(10-7-15)26-13(2)3/h6-14,24H,5H2,1-4H3,(H2,22,23,25,27)