N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide

Systemtic Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-isopentyloxy-benzamide CAS Name: 3-(3-methylbutoxy)-N-[[4-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[(4-butyramidophenyl)thiocarbamoyl]-3-isoamoxy-benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

InChI

InChI=1S/C23H29N3O3S/c1-4-6-21(27)24-18-9-11-19(12-10-18)25-23(30)26-22(28)17-7-5-8-20(15-17)29-14-13-16(2)3/h5,7-12,15-16H,4,6,13-14H2,1-3H3,(H,24,27)(H2,25,26,28,30)