N-(3-methylbutyl)-4-(3-nitrophenyl)-1,3-thiazol-2-amine

Systemtic Name: N-(3-methylbutyl)-4-(3-nitrophenyl)-1,3-thiazol-2-amine Openeye Name: N-isopentyl-4-(3-nitrophenyl)thiazol-2-amine CAS Name: N-(3-methylbutyl)-4-(3-nitrophenyl)-2-thiazolamine IUPAC Name: N-(3-methylbutyl)-4-(3-nitrophenyl)-1,3-thiazol-2-amine Traditional Name: isoamyl-[4-(3-nitrophenyl)thiazol-2-yl]amine Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O2S/c1-10(2)6-7-15-14-16-13(9-20-14)11-4-3-5-12(8-11)17(18)19/h3-5,8-10H,6-7H2,1-2H3,(H,15,16)