5-azanyl-1-[3-(diethylamino)propyl]-2-[(6-methylsulfanyl-1,3-benzodioxol-5-yl)sulfanyl]imidazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[3-(diethylamino)propyl]-2-[(6-methylsulfanyl-1,3-benzodioxol-5-yl)sulfanyl]imidazole-4-carboxamide Openeye Name: 5-amino-1-[3-(diethylamino)propyl]-2-[(6-methylsulfanyl-1,3-benzodioxol-5-yl)sulfanyl]imidazole-4-carboxamide CAS Name: 5-amino-1-[3-(diethylamino)propyl]-2-[[6-(methylthio)-1,3-benzodioxol-5-yl]thio]-4-imidazolecarboxamide IUPAC Name: 5-amino-1-[3-(diethylamino)propyl]-2-[(6-methylsulfanyl-1,3-benzodioxol-5-yl)sulfanyl]imidazole-4-carboxamide Traditional Name: 5-amino-1-[3-(diethylamino)propyl]-2-[[6-(methylthio)-1,3-benzodioxol-5-yl]thio]imidazole-4-carboxamide Formula: C19H27N5O3S2 MolecularWeight: 437.57938

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C(=C(N=C1SC2=C(C=C3C(=C2)OCO3)SC)C(=O)N)N

Isomeric SMILES

CCN(CC)CCCN1C(=C(N=C1SC2=C(C=C3C(=C2)OCO3)SC)C(=O)N)N

InChI

InChI=1S/C19H27N5O3S2/c1-4-23(5-2)7-6-8-24-17(20)16(18(21)25)22-19(24)29-15-10-13-12(26-11-27-13)9-14(15)28-3/h9-10H,4-8,11,20H2,1-3H3,(H2,21,25)