2-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(3,4-dimethylphenyl)benzamide

Systemtic Name: 2-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(3,4-dimethylphenyl)benzamide Openeye Name: 2-[(3-butoxybenzoyl)carbamothioylamino]-N-(3,4-dimethylphenyl)benzamide CAS Name: 2-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(3,4-dimethylphenyl)benzamide IUPAC Name: 2-[(3-butoxybenzoyl)carbamothioylamino]-N-(3,4-dimethylphenyl)benzamide Traditional Name: 2-[(3-butoxybenzoyl)thiocarbamoylamino]-N-(3,4-dimethylphenyl)benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C27H29N3O3S/c1-4-5-15-33-22-10-8-9-20(17-22)25(31)30-27(34)29-24-12-7-6-11-23(24)26(32)28-21-14-13-18(2)19(3)16-21/h6-14,16-17H,4-5,15H2,1-3H3,(H,28,32)(H2,29,30,31,34)