4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]-N-(3-methoxypropyl)benzamide

Systemtic Name: 4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]-N-(3-methoxypropyl)benzamide Openeye Name: 4-[(4-ethoxybenzoyl)carbamothioylamino]-N-(3-methoxypropyl)benzamide CAS Name: 4-[[[[(4-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(3-methoxypropyl)benzamide IUPAC Name: 4-[(4-ethoxybenzoyl)carbamothioylamino]-N-(3-methoxypropyl)benzamide Traditional Name: 4-[(4-ethoxybenzoyl)thiocarbamoylamino]-N-(3-methoxypropyl)benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-3-28-18-11-7-16(8-12-18)20(26)24-21(29)23-17-9-5-15(6-10-17)19(25)22-13-4-14-27-2/h5-12H,3-4,13-14H2,1-2H3,(H,22,25)(H2,23,24,26,29)