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

Systemtic Name: 3-[5-(3,5-dimethylphenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]propyl carbamate Openeye Name: 3-[5-(3,5-dimethylphenyl)sulfanyl-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]propyl carbamate CAS Name: carbamic acid 3-[5-[(3,5-dimethylphenyl)thio]-4-propan-2-yl-1-(pyridin-4-ylmethyl)-2-imidazolyl]propyl ester IUPAC Name: 3-[5-(3,5-dimethylphenyl)sulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)imidazol-2-yl]propyl carbamate Traditional Name: carbamic acid 3-[5-[(3,5-dimethylphenyl)thio]-4-isopropyl-1-(4-pyridylmethyl)imidazol-2-yl]propyl ester Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C(N=C(N2CC3=CC=NC=C3)CCCOC(=O)N)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C(N=C(N2CC3=CC=NC=C3)CCCOC(=O)N)C(C)C)C

InChI

InChI=1S/C24H30N4O2S/c1-16(2)22-23(31-20-13-17(3)12-18(4)14-20)28(15-19-7-9-26-10-8-19)21(27-22)6-5-11-30-24(25)29/h7-10,12-14,16H,5-6,11,15H2,1-4H3,(H2,25,29)