2-[(4-tert-butylphenyl)carbonylcarbamothioylamino]-N-(3-methoxypropyl)benzamide

Systemtic Name: 2-[(4-tert-butylphenyl)carbonylcarbamothioylamino]-N-(3-methoxypropyl)benzamide Openeye Name: 2-[(4-tert-butylbenzoyl)carbamothioylamino]-N-(3-methoxypropyl)benzamide CAS Name: 2-[[[[(4-tert-butylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(3-methoxypropyl)benzamide IUPAC Name: 2-[(4-tert-butylbenzoyl)carbamothioylamino]-N-(3-methoxypropyl)benzamide Traditional Name: 2-[(4-tert-butylbenzoyl)thiocarbamoylamino]-N-(3-methoxypropyl)benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCOC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCOC

InChI

InChI=1S/C23H29N3O3S/c1-23(2,3)17-12-10-16(11-13-17)20(27)26-22(30)25-19-9-6-5-8-18(19)21(28)24-14-7-15-29-4/h5-6,8-13H,7,14-15H2,1-4H3,(H,24,28)(H2,25,26,27,30)