1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-oxolanylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(oxolan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-1-(3-pyridylmethyl)-3-(tetrahydrofurfuryl)thiourea Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CN=CC=C3)C(=S)NCC4CCCO4

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CN=CC=C3)C(=S)NCC4CCCO4

InChI

InChI=1S/C23H26N4O2S/c1-16-5-2-7-18-11-19(22(28)26-21(16)18)15-27(14-17-6-3-9-24-12-17)23(30)25-13-20-8-4-10-29-20/h2-3,5-7,9,11-12,20H,4,8,10,13-15H2,1H3,(H,25,30)(H,26,28)