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

Systemtic Name: N-(oxolan-2-ylmethyl)-3-[(4-propan-2-yloxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 3-[(4-isopropoxybenzoyl)carbamothioylamino]-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-(2-oxolanylmethyl)-3-[[[[oxo-(4-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(oxolan-2-ylmethyl)-3-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzamide Traditional Name: 3-[(4-isopropoxybenzoyl)thiocarbamoylamino]-N-(tetrahydrofurfuryl)benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3CCCO3

InChI

InChI=1S/C23H27N3O4S/c1-15(2)30-19-10-8-16(9-11-19)22(28)26-23(31)25-18-6-3-5-17(13-18)21(27)24-14-20-7-4-12-29-20/h3,5-6,8-11,13,15,20H,4,7,12,14H2,1-2H3,(H,24,27)(H2,25,26,28,31)