N,N-bis(benzotriazol-1-ylmethyl)-3-phenylsulfanyl-propan-1-amine

Systemtic Name: N,N-bis(benzotriazol-1-ylmethyl)-3-phenylsulfanyl-propan-1-amine Openeye Name: N,N-bis(benzotriazol-1-ylmethyl)-3-phenylsulfanyl-propan-1-amine CAS Name: N,N-bis(1-benzotriazolylmethyl)-3-(phenylthio)-1-propanamine IUPAC Name: N,N-bis(benzotriazol-1-ylmethyl)-3-phenylsulfanylpropan-1-amine Traditional Name: bis(benzotriazol-1-ylmethyl)-[3-(phenylthio)propyl]amine Formula: C23H23N7S MolecularWeight: 429.54062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCN(CN2C3=CC=CC=C3N=N2)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)SCCCN(CN2C3=CC=CC=C3N=N2)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H23N7S/c1-2-9-19(10-3-1)31-16-8-15-28(17-29-22-13-6-4-11-20(22)24-26-29)18-30-23-14-7-5-12-21(23)25-27-30/h1-7,9-14H,8,15-18H2