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

Systemtic Name: 2-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl carbamate Openeye Name: 2-[4-isopropyl-5-phenylsulfanyl-1-(4-pyridylmethyl)imidazol-2-yl]ethyl carbamate CAS Name: carbamic acid 2-[5-(phenylthio)-4-propan-2-yl-1-(pyridin-4-ylmethyl)-2-imidazolyl]ethyl ester IUPAC Name: 2-[5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]ethyl carbamate Traditional Name: carbamic acid 2-[4-isopropyl-5-(phenylthio)-1-(4-pyridylmethyl)imidazol-2-yl]ethyl ester Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCOC(=O)N)CC2=CC=NC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCOC(=O)N)CC2=CC=NC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2S/c1-15(2)19-20(28-17-6-4-3-5-7-17)25(14-16-8-11-23-12-9-16)18(24-19)10-13-27-21(22)26/h3-9,11-12,15H,10,13-14H2,1-2H3,(H2,22,26)