1-[(4-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)-3-pyridin-3-yl-thiourea

Systemtic Name: 1-[(4-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)-3-pyridin-3-yl-thiourea Openeye Name: 1-(3-morpholinopropyl)-1-(p-tolylmethyl)-3-(3-pyridyl)thiourea CAS Name: 1-[(4-methylphenyl)methyl]-1-[3-(4-morpholinyl)propyl]-3-(3-pyridinyl)thiourea IUPAC Name: 1-[(4-methylphenyl)methyl]-1-(3-morpholin-4-ylpropyl)-3-pyridin-3-ylthiourea Traditional Name: 1-(4-methylbenzyl)-1-(3-morpholinopropyl)-3-(3-pyridyl)thiourea Formula: C21H28N4OS MolecularWeight: 384.53822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CCCN2CCOCC2)C(=S)NC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CN(CCCN2CCOCC2)C(=S)NC3=CN=CC=C3

InChI

InChI=1S/C21H28N4OS/c1-18-5-7-19(8-6-18)17-25(11-3-10-24-12-14-26-15-13-24)21(27)23-20-4-2-9-22-16-20/h2,4-9,16H,3,10-15,17H2,1H3,(H,23,27)