N-[[2-methoxy-5-(oxan-4-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: N-[[2-methoxy-5-(oxan-4-yl)phenyl]carbamothioyl]benzamide Openeye Name: N-[(2-methoxy-5-tetrahydropyran-4-yl-phenyl)carbamothioyl]benzamide CAS Name: N-[[2-methoxy-5-(4-oxanyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[2-methoxy-5-(oxan-4-yl)phenyl]carbamothioyl]benzamide Traditional Name: N-[(2-methoxy-5-tetrahydropyran-4-yl-phenyl)thiocarbamoyl]benzamide Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCOCC2)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCOCC2)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3S/c1-24-18-8-7-16(14-9-11-25-12-10-14)13-17(18)21-20(26)22-19(23)15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3,(H2,21,22,23,26)