1-cyclopentyl-3-(3-methyl-2-propan-2-yl-phenyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-cyclopentyl-3-(3-methyl-2-propan-2-yl-phenyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-cyclopentyl-3-(2-isopropyl-3-methyl-phenyl)-1-(4-pyridylmethyl)thiourea CAS Name: 1-cyclopentyl-3-(3-methyl-2-propan-2-ylphenyl)-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-cyclopentyl-3-(3-methyl-2-propan-2-ylphenyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-cyclopentyl-3-(2-isopropyl-3-methyl-phenyl)-1-(4-pyridylmethyl)thiourea Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N(CC2=CC=NC=C2)C3CCCC3)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N(CC2=CC=NC=C2)C3CCCC3)C(C)C

InChI

InChI=1S/C22H29N3S/c1-16(2)21-17(3)7-6-10-20(21)24-22(26)25(19-8-4-5-9-19)15-18-11-13-23-14-12-18/h6-7,10-14,16,19H,4-5,8-9,15H2,1-3H3,(H,24,26)