N-(2-azanyl-3-heptan-4-ylsulfonyl-propanoyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide hydrochloride

Systemtic Name: N-(2-azanyl-3-heptan-4-ylsulfonyl-propanoyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide hydrochloride Openeye Name: N-[2-amino-3-(1-propylbutylsulfonyl)propanoyl]-2,4-dimethyl-thiazole-5-carboxamide hydrochloride CAS Name: N-(2-amino-3-heptan-4-ylsulfonyl-1-oxopropyl)-2,4-dimethyl-5-thiazolecarboxamide hydrochloride IUPAC Name: N-(2-amino-3-heptan-4-ylsulfonylpropanoyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide hydrochloride Traditional Name: N-[2-amino-3-(1-propylbutylsulfonyl)propanoyl]-2,4-dimethyl-thiazole-5-carboxamide hydrochloride Formula: C16H28ClN3O4S2 MolecularWeight: 425.99422

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C1=C(N=C(S1)C)C)N.Cl

Isomeric SMILES

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C1=C(N=C(S1)C)C)N.Cl

InChI

InChI=1S/C16H27N3O4S2.ClH/c1-5-7-12(8-6-2)25(22,23)9-13(17)15(20)19-16(21)14-10(3)18-11(4)24-14;/h12-13H,5-9,17H2,1-4H3,(H,19,20,21);1H