2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-3-chloranyl-aniline

Systemtic Name: 2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-3-chloranyl-aniline Openeye Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-3-chloro-aniline CAS Name: 2-[(1-butyl-5-tetrazolyl)methylthio]-3-chloroaniline IUPAC Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-3-chloroaniline Traditional Name: [2-[(1-butyltetrazol-5-yl)methylthio]-3-chloro-phenyl]amine Formula: C12H16ClN5S MolecularWeight: 297.80694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=C(C=CC=C2Cl)N

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=C(C=CC=C2Cl)N

InChI

InChI=1S/C12H16ClN5S/c1-2-3-7-18-11(15-16-17-18)8-19-12-9(13)5-4-6-10(12)14/h4-6H,2-3,7-8,14H2,1H3