N-(3-oxidanylpropyl)-2-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3-oxidanylpropyl)-2-[(4-pentoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-hydroxypropyl)-2-[(4-pentoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-hydroxypropyl)-2-[[[[oxo-(4-pentoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-2-[(4-pentoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 2-[(4-amoxybenzoyl)thiocarbamoylamino]-N-(3-hydroxypropyl)benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

InChI

InChI=1S/C23H29N3O4S/c1-2-3-6-16-30-18-12-10-17(11-13-18)21(28)26-23(31)25-20-9-5-4-8-19(20)22(29)24-14-7-15-27/h4-5,8-13,27H,2-3,6-7,14-16H2,1H3,(H,24,29)(H2,25,26,28,31)