4-[4-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboximidamide hydrochloride

Systemtic Name: 4-[4-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)-1,3-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboximidamide hydrochloride Openeye Name: 4-[4-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxamidine hydrochloride CAS Name: 4-[4-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)-2-thiazolyl]-5-(methylthio)-2-thiophenecarboximidamide hydrochloride IUPAC Name: 4-[4-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboximidamide hydrochloride Traditional Name: 4-[4-(3-methyl-3,4-dihydro-1,2-benzodioxin-7-yl)thiazol-2-yl]-5-(methylthio)thiophene-2-carboxamidine hydrochloride Formula: C18H18ClN3O2S3 MolecularWeight: 440.00242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=C(C=C2)C3=CSC(=N3)C4=C(SC(=C4)C(=N)N)SC)OO1.Cl

Isomeric SMILES

CC1CC2=C(C=C(C=C2)C3=CSC(=N3)C4=C(SC(=C4)C(=N)N)SC)OO1.Cl

InChI

InChI=1S/C18H17N3O2S3.ClH/c1-9-5-11-4-3-10(6-14(11)23-22-9)13-8-25-17(21-13)12-7-15(16(19)20)26-18(12)24-2;/h3-4,6-9H,5H2,1-2H3,(H3,19,20);1H