1-[(7-chloranyl-6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(2-methylpropyl)thiourea

Systemtic Name: 1-[(7-chloranyl-6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(2-methylpropyl)thiourea Openeye Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furylmethyl)-3-isobutyl-thiourea CAS Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furanylmethyl)-3-(2-methylpropyl)thiourea IUPAC Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(2-methylpropyl)thiourea Traditional Name: 1-[(7-chloro-2-keto-6-methyl-1H-quinolin-3-yl)methyl]-1-(2-furfuryl)-3-isobutyl-thiourea Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CO3)C(=S)NCC(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CO3)C(=S)NCC(C)C)Cl

InChI

InChI=1S/C21H24ClN3O2S/c1-13(2)10-23-21(28)25(12-17-5-4-6-27-17)11-16-8-15-7-14(3)18(22)9-19(15)24-20(16)26/h4-9,13H,10-12H2,1-3H3,(H,23,28)(H,24,26)