N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloranyl-4-nitro-aniline

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloranyl-4-nitro-aniline Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitro-aniline CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitroaniline IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitroaniline Traditional Name: 2-(1,3-benzothiazol-2-yl)ethyl-(2-chloro-4-nitro-phenyl)amine Formula: C15H12ClN3O2S MolecularWeight: 333.79268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H12ClN3O2S/c16-11-9-10(19(20)21)5-6-12(11)17-8-7-15-18-13-3-1-2-4-14(13)22-15/h1-6,9,17H,7-8H2