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

Systemtic Name: N-ethyl-2-[(4-heptoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-ethyl-2-[(4-heptoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-ethyl-2-[[[[(4-heptoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-ethyl-2-[(4-heptoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-ethyl-2-[(4-heptoxybenzoyl)thiocarbamoylamino]benzamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O3S/c1-3-5-6-7-10-17-30-19-15-13-18(14-16-19)22(28)27-24(31)26-21-12-9-8-11-20(21)23(29)25-4-2/h8-9,11-16H,3-7,10,17H2,1-2H3,(H,25,29)(H2,26,27,28,31)