4-(3-methylbutoxy)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 4-(3-methylbutoxy)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]benzamide Openeye Name: 4-isopentyloxy-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-(3-methylbutoxy)-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(3-methylbutoxy)-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]benzamide Traditional Name: 4-isoamoxy-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H27N3O3S/c1-17(2)14-15-31-21-12-10-19(11-13-21)24(30)26-25(32)28-27-23(29)16-20-8-5-7-18-6-3-4-9-22(18)20/h3-13,17H,14-16H2,1-2H3,(H,27,29)(H2,26,28,30,32)