2-[(4-heptoxyphenyl)carbonylcarbamothioylamino]-N-(2-hydroxyethyl)benzamide

Systemtic Name: 2-[(4-heptoxyphenyl)carbonylcarbamothioylamino]-N-(2-hydroxyethyl)benzamide Openeye Name: 2-[(4-heptoxybenzoyl)carbamothioylamino]-N-(2-hydroxyethyl)benzamide CAS Name: 2-[[[[(4-heptoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(2-hydroxyethyl)benzamide IUPAC Name: 2-[(4-heptoxybenzoyl)carbamothioylamino]-N-(2-hydroxyethyl)benzamide Traditional Name: 2-[(4-heptoxybenzoyl)thiocarbamoylamino]-N-(2-hydroxyethyl)benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCO

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCO

InChI

InChI=1S/C24H31N3O4S/c1-2-3-4-5-8-17-31-19-13-11-18(12-14-19)22(29)27-24(32)26-21-10-7-6-9-20(21)23(30)25-15-16-28/h6-7,9-14,28H,2-5,8,15-17H2,1H3,(H,25,30)(H2,26,27,29,32)