1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(2-methoxyethyl)thiourea

Systemtic Name: 1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(2-methoxyethyl)thiourea Openeye Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furylmethyl)-3-(2-methoxyethyl)thiourea CAS Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furanylmethyl)-3-(2-methoxyethyl)thiourea IUPAC Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-(2-methoxyethyl)thiourea Traditional Name: 1-(2-furfuryl)-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(2-methoxyethyl)thiourea Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CO3)C(=S)NCCOC)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CO3)C(=S)NCCOC)C

InChI

InChI=1S/C21H25N3O3S/c1-14-9-15(2)18-11-16(20(25)23-19(18)10-14)12-24(13-17-5-4-7-27-17)21(28)22-6-8-26-3/h4-5,7,9-11H,6,8,12-13H2,1-3H3,(H,22,28)(H,23,25)