2-[(2-butoxyphenyl)carbonylcarbamothioyl-methyl-amino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[(2-butoxyphenyl)carbonylcarbamothioyl-methyl-amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(2-butoxybenzoyl)carbamothioyl-methyl-amino]benzamide CAS Name: 2-[[[[(2-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]-methylamino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[(2-butoxybenzoyl)carbamothioyl-methylamino]benzamide Traditional Name: N-benzyl-2-[(2-butoxybenzoyl)thiocarbamoyl-methyl-amino]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-3-4-18-33-24-17-11-9-15-22(24)26(32)29-27(34)30(2)23-16-10-8-14-21(23)25(31)28-19-20-12-6-5-7-13-20/h5-17H,3-4,18-19H2,1-2H3,(H,28,31)(H,29,32,34)