N-[(3-hexoxyphenyl)carbamothioyl]-3-(3-methylbutoxy)benzamide

Systemtic Name: N-[(3-hexoxyphenyl)carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[(3-hexoxyphenyl)carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[(3-hexoxyanilino)-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[(3-hexoxyphenyl)carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[(3-hexoxyphenyl)thiocarbamoyl]-3-isoamoxy-benzamide Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCCC(C)C

InChI

InChI=1S/C25H34N2O3S/c1-4-5-6-7-15-29-23-13-9-11-21(18-23)26-25(31)27-24(28)20-10-8-12-22(17-20)30-16-14-19(2)3/h8-13,17-19H,4-7,14-16H2,1-3H3,(H2,26,27,28,31)