N-[(4-methoxyphenyl)methylcarbamothioyl]-3-(3-methylbutoxy)benzamide

Systemtic Name: N-[(4-methoxyphenyl)methylcarbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: 3-isopentyloxy-N-[(4-methoxyphenyl)methylcarbamothioyl]benzamide CAS Name: N-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[(4-methoxyphenyl)methylcarbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: 3-isoamoxy-N-(p-anisylthiocarbamoyl)benzamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N2O3S/c1-15(2)11-12-26-19-6-4-5-17(13-19)20(24)23-21(27)22-14-16-7-9-18(25-3)10-8-16/h4-10,13,15H,11-12,14H2,1-3H3,(H2,22,23,24,27)