N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 3-methoxy-N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[(3-butyramidophenyl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2OC

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2OC

InChI

InChI=1S/C23H23N3O3S/c1-3-7-21(27)24-17-10-6-11-18(14-17)25-23(30)26-22(28)19-12-15-8-4-5-9-16(15)13-20(19)29-2/h4-6,8-14H,3,7H2,1-2H3,(H,24,27)(H2,25,26,28,30)