1-(3-imidazol-1-ylpropyl)-3-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-3-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(3-imidazol-1-ylpropyl)-3-(4-isopropylphenyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-[3-(1-imidazolyl)propyl]-3-(4-propan-2-ylphenyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-3-(4-propan-2-ylphenyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-(3-imidazol-1-ylpropyl)-3-p-cumenyl-1-(3-pyridylmethyl)thiourea Formula: C22H27N5S MolecularWeight: 393.54828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CN=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N(CCCN2C=CN=C2)CC3=CN=CC=C3

InChI

InChI=1S/C22H27N5S/c1-18(2)20-6-8-21(9-7-20)25-22(28)27(16-19-5-3-10-23-15-19)13-4-12-26-14-11-24-17-26/h3,5-11,14-15,17-18H,4,12-13,16H2,1-2H3,(H,25,28)