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

Systemtic Name: N-(3-oxidanylpropyl)-2-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-hydroxypropyl)-2-[(4-isopropoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-hydroxypropyl)-2-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-2-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(3-hydroxypropyl)-2-[(4-isopropoxybenzoyl)thiocarbamoylamino]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

InChI

InChI=1S/C21H25N3O4S/c1-14(2)28-16-10-8-15(9-11-16)19(26)24-21(29)23-18-7-4-3-6-17(18)20(27)22-12-5-13-25/h3-4,6-11,14,25H,5,12-13H2,1-2H3,(H,22,27)(H2,23,24,26,29)