butyl N'-[5-[(4-methylphenyl)carbamoyl]-1-(2-oxidanylidenepropyl)imidazol-4-yl]-N-phenyl-carbamimidothioate

Systemtic Name: butyl N'-[5-[(4-methylphenyl)carbamoyl]-1-(2-oxidanylidenepropyl)imidazol-4-yl]-N-phenyl-carbamimidothioate Openeye Name: 3-acetonyl-5-[[anilino(butylsulfanyl)methylene]amino]-N-(p-tolyl)imidazole-4-carboxamide CAS Name: N'-[5-[(4-methylanilino)-oxomethyl]-1-(2-oxopropyl)-4-imidazolyl]-N-phenylcarbamimidothioic acid butyl ester IUPAC Name: butyl N'-[5-[(4-methylphenyl)carbamoyl]-1-(2-oxopropyl)imidazol-4-yl]-N-phenylcarbamimidothioate Traditional Name: 3-acetonyl-5-[[anilino-(butylthio)methylene]amino]-N-(p-tolyl)imidazole-4-carboxamide Formula: C25H29N5O2S MolecularWeight: 463.59506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=NC1=C(N(C=N1)CC(=O)C)C(=O)NC2=CC=C(C=C2)C)NC3=CC=CC=C3

Isomeric SMILES

CCCCSC(=NC1=C(N(C=N1)CC(=O)C)C(=O)NC2=CC=C(C=C2)C)NC3=CC=CC=C3

InChI

InChI=1S/C25H29N5O2S/c1-4-5-15-33-25(28-20-9-7-6-8-10-20)29-23-22(30(17-26-23)16-19(3)31)24(32)27-21-13-11-18(2)12-14-21/h6-14,17H,4-5,15-16H2,1-3H3,(H,27,32)(H,28,29)