[2-[(1S)-1-(benzotriazol-1-yl)propyl]sulfanyl-4-methoxy-phenyl]-phenyl-methanone

Systemtic Name: [2-[(1S)-1-(benzotriazol-1-yl)propyl]sulfanyl-4-methoxy-phenyl]-phenyl-methanone Openeye Name: [2-[(1S)-1-(benzotriazol-1-yl)propyl]sulfanyl-4-methoxy-phenyl]-phenyl-methanone CAS Name: [2-[[(1S)-1-(1-benzotriazolyl)propyl]thio]-4-methoxyphenyl]-phenylmethanone IUPAC Name: [2-[(1S)-1-(benzotriazol-1-yl)propyl]sulfanyl-4-methoxyphenyl]-phenylmethanone Traditional Name: [2-[[(1S)-1-(benzotriazol-1-yl)propyl]thio]-4-methoxy-phenyl]-phenyl-methanone Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C2=CC=CC=C2N=N1)SC3=C(C=CC(=C3)OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC[C@@H](N1C2=CC=CC=C2N=N1)SC3=C(C=CC(=C3)OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-3-22(26-20-12-8-7-11-19(20)24-25-26)29-21-15-17(28-2)13-14-18(21)23(27)16-9-5-4-6-10-16/h4-15,22H,3H2,1-2H3/t22-/m0/s1