4-[(2S)-2-ethyl-4-hexyl-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-thiazol-2-amine

Systemtic Name: 4-[(2S)-2-ethyl-4-hexyl-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-thiazol-2-amine Openeye Name: 4-[(2S)-2-ethyl-4-hexyl-2,3-dihydro-1,4-benzoxazin-6-yl]thiazol-2-amine CAS Name: 4-[(2S)-2-ethyl-4-hexyl-2,3-dihydro-1,4-benzoxazin-6-yl]-2-thiazolamine IUPAC Name: 4-[(2S)-2-ethyl-4-hexyl-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-thiazol-2-amine Traditional Name: [4-[(2S)-2-ethyl-4-hexyl-2,3-dihydro-1,4-benzoxazin-6-yl]thiazol-2-yl]amine Formula: C19H27N3OS MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CC(OC2=C1C=C(C=C2)C3=CSC(=N3)N)CC

Isomeric SMILES

CCCCCCN1C[C@@H](OC2=C1C=C(C=C2)C3=CSC(=N3)N)CC

InChI

InChI=1S/C19H27N3OS/c1-3-5-6-7-10-22-12-15(4-2)23-18-9-8-14(11-17(18)22)16-13-24-19(20)21-16/h8-9,11,13,15H,3-7,10,12H2,1-2H3,(H2,20,21)/t15-/m0/s1