2,6-bis(azanyl)hexanamide; 4-(5-fluoranyl-1,3-benzothiazol-2-yl)-2-methyl-aniline

Systemtic Name: 2,6-bis(azanyl)hexanamide; 4-(5-fluoranyl-1,3-benzothiazol-2-yl)-2-methyl-aniline Openeye Name: 2,6-diaminohexanamide; 4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methyl-aniline CAS Name: 2,6-diaminohexanamide; 4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methylaniline IUPAC Name: 2,6-diaminohexanamide; 4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methylaniline Traditional Name: 2,6-diaminohexanamide; [4-(5-fluoro-1,3-benzothiazol-2-yl)-2-methyl-phenyl]amine Formula: C20H26FN5OS MolecularWeight: 403.516743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=C(S2)C=CC(=C3)F)N.C(CCN)CC(C(=O)N)N

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=C(S2)C=CC(=C3)F)N.C(CCN)CC(C(=O)N)N

InChI

InChI=1S/C14H11FN2S.C6H15N3O/c1-8-6-9(2-4-11(8)16)14-17-12-7-10(15)3-5-13(12)18-14;7-4-2-1-3-5(8)6(9)10/h2-7H,16H2,1H3;5H,1-4,7-8H2,(H2,9,10)