N-[(3-ethoxyphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: N-[(3-ethoxyphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: N-[(3-ethoxyphenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: N-[(3-ethoxyanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: N-[(3-ethoxyphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: 4-isoamoxy-N-(m-phenetylthiocarbamoyl)benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-25-19-7-5-6-17(14-19)22-21(27)23-20(24)16-8-10-18(11-9-16)26-13-12-15(2)3/h5-11,14-15H,4,12-13H2,1-3H3,(H2,22,23,24,27)