N-[4-[(4-butoxyphenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]-2-chloranyl-benzamide

Systemtic Name: N-[4-[(4-butoxyphenyl)carbonylcarbamothioylamino]-2-methoxy-phenyl]-2-chloranyl-benzamide Openeye Name: N-[4-[(4-butoxybenzoyl)carbamothioylamino]-2-methoxy-phenyl]-2-chloro-benzamide CAS Name: N-[4-[[[[(4-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]-2-chlorobenzamide IUPAC Name: N-[4-[(4-butoxybenzoyl)carbamothioylamino]-2-methoxyphenyl]-2-chlorobenzamide Traditional Name: N-[4-[(4-butoxybenzoyl)thiocarbamoylamino]-2-methoxy-phenyl]-2-chloro-benzamide Formula: C26H26ClN3O4S MolecularWeight: 512.02034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)OC

InChI

InChI=1S/C26H26ClN3O4S/c1-3-4-15-34-19-12-9-17(10-13-19)24(31)30-26(35)28-18-11-14-22(23(16-18)33-2)29-25(32)20-7-5-6-8-21(20)27/h5-14,16H,3-4,15H2,1-2H3,(H,29,32)(H2,28,30,31,35)