1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)-3-(1-phenylethyl)thiourea

Systemtic Name: 1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)-3-(1-phenylethyl)thiourea Openeye Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-oxolanylmethyl)-3-(1-phenylethyl)thiourea IUPAC Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(oxolan-2-ylmethyl)-3-(1-phenylethyl)thiourea Traditional Name: 1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)-1-(tetrahydrofurfuryl)thiourea Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC3CCCO3)C(=S)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CC3CCCO3)C(=S)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2S/c1-17-11-12-18(2)24-23(17)14-21(25(30)28-24)15-29(16-22-10-7-13-31-22)26(32)27-19(3)20-8-5-4-6-9-20/h4-6,8-9,11-12,14,19,22H,7,10,13,15-16H2,1-3H3,(H,27,32)(H,28,30)