3-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-3-ylmethyl)imidazol-2-yl]propyl carbamate

Systemtic Name: 3-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-3-ylmethyl)imidazol-2-yl]propyl carbamate Openeye Name: 3-[4-isopropyl-5-phenylsulfanyl-1-(3-pyridylmethyl)imidazol-2-yl]propyl carbamate CAS Name: carbamic acid 3-[5-(phenylthio)-4-propan-2-yl-1-(3-pyridinylmethyl)-2-imidazolyl]propyl ester IUPAC Name: 3-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-3-ylmethyl)imidazol-2-yl]propyl carbamate Traditional Name: carbamic acid 3-[4-isopropyl-5-(phenylthio)-1-(3-pyridylmethyl)imidazol-2-yl]propyl ester Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCCOC(=O)N)CC2=CN=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCCOC(=O)N)CC2=CN=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-16(2)20-21(29-18-9-4-3-5-10-18)26(15-17-8-6-12-24-14-17)19(25-20)11-7-13-28-22(23)27/h3-6,8-10,12,14,16H,7,11,13,15H2,1-2H3,(H2,23,27)