1-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-methyl-amino]-3-phenyl-thiourea

Systemtic Name: 1-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-methyl-amino]-3-phenyl-thiourea Openeye Name: 1-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-methyl-amino]-3-phenyl-thiourea CAS Name: 1-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-methylamino]-3-phenylthiourea IUPAC Name: 1-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-methylamino]-3-phenylthiourea Traditional Name: 1-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]-methyl-amino]-3-phenyl-thiourea Formula: C18H13F6N5S MolecularWeight: 445.384739

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=C(C=C1)C(=CC(=N2)C(F)(F)F)C(F)(F)F)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CN(C1=NC2=C(C=C1)C(=CC(=N2)C(F)(F)F)C(F)(F)F)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C18H13F6N5S/c1-29(28-16(30)25-10-5-3-2-4-6-10)14-8-7-11-12(17(19,20)21)9-13(18(22,23)24)26-15(11)27-14/h2-9H,1H3,(H2,25,28,30)