3-(2-chloranyl-4-methoxy-phenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-(2-chloranyl-4-methoxy-phenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-(2-chloro-4-methoxy-phenyl)-1-(2-morpholinoethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 3-(2-chloro-4-methoxyphenyl)-1-[2-(4-morpholinyl)ethyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-(2-chloro-4-methoxyphenyl)-1-(2-morpholin-4-ylethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(2-chloro-4-methoxy-phenyl)-1-(2-morpholinoethyl)-1-(3-pyridylmethyl)thiourea Formula: C20H25ClN4O2S MolecularWeight: 420.9561

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)N(CCN2CCOCC2)CC3=CN=CC=C3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)N(CCN2CCOCC2)CC3=CN=CC=C3)Cl

InChI

InChI=1S/C20H25ClN4O2S/c1-26-17-4-5-19(18(21)13-17)23-20(28)25(15-16-3-2-6-22-14-16)8-7-24-9-11-27-12-10-24/h2-6,13-14H,7-12,15H2,1H3,(H,23,28)