2-[1-[3-[(4-chlorophenyl)-propan-2-yl-amino]-2-oxidanyl-propyl]imidazol-4-yl]ethanenitrile

Systemtic Name: 2-[1-[3-[(4-chlorophenyl)-propan-2-yl-amino]-2-oxidanyl-propyl]imidazol-4-yl]ethanenitrile Openeye Name: 2-[1-[3-(4-chloro-N-isopropyl-anilino)-2-hydroxy-propyl]imidazol-4-yl]acetonitrile CAS Name: 2-[1-[3-(4-chloro-N-propan-2-ylanilino)-2-hydroxypropyl]-4-imidazolyl]acetonitrile IUPAC Name: 2-[1-[3-(4-chloro-N-propan-2-ylanilino)-2-hydroxypropyl]imidazol-4-yl]acetonitrile Traditional Name: 2-[1-[3-(4-chloro-N-isopropyl-anilino)-2-hydroxy-propyl]imidazol-4-yl]acetonitrile Formula: C17H21ClN4O MolecularWeight: 332.82784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(CN1C=C(N=C1)CC#N)O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)N(CC(CN1C=C(N=C1)CC#N)O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H21ClN4O/c1-13(2)22(16-5-3-14(18)4-6-16)11-17(23)10-21-9-15(7-8-19)20-12-21/h3-6,9,12-13,17,23H,7,10-11H2,1-2H3