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

Systemtic Name: 1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-oxolanylmethyl)-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)thiourea Traditional Name: 3-benzyl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-1-(tetrahydrofurfuryl)thiourea Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3CCCO3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S/c1-17-7-5-10-19-13-20(23(28)26-22(17)19)15-27(16-21-11-6-12-29-21)24(30)25-14-18-8-3-2-4-9-18/h2-5,7-10,13,21H,6,11-12,14-16H2,1H3,(H,25,30)(H,26,28)