methyl N'-[4-[6-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]butyl]carbamimidothioate

Systemtic Name: methyl N'-[4-[6-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]butyl]carbamimidothioate Openeye Name: 2-methyl-3-[4-[6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]butyl]isothiourea CAS Name: N'-[4-[6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]butyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[4-[6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]butyl]carbamimidothioate Traditional Name: 3-[4-[6-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]butyl]-2-methyl-isothiourea Formula: C18H24N6OS MolecularWeight: 372.48776

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC3=C(C=C2)N=C(N3)CCCCN=C(N)SC

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC3=C(C=C2)N=C(N3)CCCCN=C(N)SC

InChI

InChI=1S/C18H24N6OS/c1-11-9-16(25)23-24-17(11)12-6-7-13-14(10-12)22-15(21-13)5-3-4-8-20-18(19)26-2/h6-7,10-11H,3-5,8-9H2,1-2H3,(H2,19,20)(H,21,22)(H,23,25)