3-(3-methylbutoxy)-N-[(4-prop-2-enoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-[(4-prop-2-enoxyphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-allyloxyphenyl)carbamothioyl]-3-isopentyloxy-benzamide CAS Name: 3-(3-methylbutoxy)-N-[(4-prop-2-enoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-[(4-prop-2-enoxyphenyl)carbamothioyl]benzamide Traditional Name: N-[(4-allyloxyphenyl)thiocarbamoyl]-3-isoamoxy-benzamide Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC=C

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C22H26N2O3S/c1-4-13-26-19-10-8-18(9-11-19)23-22(28)24-21(25)17-6-5-7-20(15-17)27-14-12-16(2)3/h4-11,15-16H,1,12-14H2,2-3H3,(H2,23,24,25,28)