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

Systemtic Name: 2-[(4-heptoxyphenyl)carbonylcarbamothioylamino]-N-(2-methoxyethyl)benzamide Openeye Name: 2-[(4-heptoxybenzoyl)carbamothioylamino]-N-(2-methoxyethyl)benzamide CAS Name: 2-[[[[(4-heptoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(2-methoxyethyl)benzamide IUPAC Name: 2-[(4-heptoxybenzoyl)carbamothioylamino]-N-(2-methoxyethyl)benzamide Traditional Name: 2-[(4-heptoxybenzoyl)thiocarbamoylamino]-N-(2-methoxyethyl)benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O4S/c1-3-4-5-6-9-17-32-20-14-12-19(13-15-20)23(29)28-25(33)27-22-11-8-7-10-21(22)24(30)26-16-18-31-2/h7-8,10-15H,3-6,9,16-18H2,1-2H3,(H,26,30)(H2,27,28,29,33)