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

Systemtic Name: 2-[(4-hexoxyphenyl)carbonylcarbamothioylamino]-N-(2-hydroxyethyl)benzamide Openeye Name: 2-[(4-hexoxybenzoyl)carbamothioylamino]-N-(2-hydroxyethyl)benzamide CAS Name: 2-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(2-hydroxyethyl)benzamide IUPAC Name: 2-[(4-hexoxybenzoyl)carbamothioylamino]-N-(2-hydroxyethyl)benzamide Traditional Name: 2-[(4-hexoxybenzoyl)thiocarbamoylamino]-N-(2-hydroxyethyl)benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCO

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCO

InChI

InChI=1S/C23H29N3O4S/c1-2-3-4-7-16-30-18-12-10-17(11-13-18)21(28)26-23(31)25-20-9-6-5-8-19(20)22(29)24-14-15-27/h5-6,8-13,27H,2-4,7,14-16H2,1H3,(H,24,29)(H2,25,26,28,31)