N',N'-diethyl-N-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine

Systemtic Name: N',N'-diethyl-N-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine Openeye Name: N',N'-diethyl-N-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine CAS Name: N',N'-diethyl-N-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine IUPAC Name: N',N'-diethyl-N-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)ethane-1,2-diamine Traditional Name: diethyl-[2-[(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amino]ethyl]amine Formula: C14H20N4O2S MolecularWeight: 308.3992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C(C=C2C(=C1)N=C(S2)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNC1=C(C=C2C(=C1)N=C(S2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O2S/c1-4-17(5-2)7-6-15-11-8-12-14(21-10(3)16-12)9-13(11)18(19)20/h8-9,15H,4-7H2,1-3H3