(2S)-2,6-bis(azanyl)-N-[4-(5-fluoranyl-1,3-benzothiazol-2-yl)-2-methyl-phenyl]hexanamide hydrochloride

Systemtic Name: (2S)-2,6-bis(azanyl)-N-[4-(5-fluoranyl-1,3-benzothiazol-2-yl)-2-methyl-phenyl]hexanamide hydrochloride Openeye Name: (2S)-2,6-diamino-N-[4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methyl-phenyl]hexanamide hydrochloride CAS Name: (2S)-2,6-diamino-N-[4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methylphenyl]hexanamide hydrochloride IUPAC Name: (2S)-2,6-diamino-N-[4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methylphenyl]hexanamide hydrochloride Traditional Name: (2S)-2,6-diamino-N-[4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methyl-phenyl]hexanamide hydrochloride Formula: C20H24ClFN4OS MolecularWeight: 422.947163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=C(S2)C=CC(=C3)F)NC(=O)C(CCCCN)N.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=C(S2)C=CC(=C3)F)NC(=O)[C@H](CCCCN)N.Cl

InChI

InChI=1S/C20H23FN4OS.ClH/c1-12-10-13(20-25-17-11-14(21)6-8-18(17)27-20)5-7-16(12)24-19(26)15(23)4-2-3-9-22;/h5-8,10-11,15H,2-4,9,22-23H2,1H3,(H,24,26);1H/t15-;/m0./s1