3-butyl-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 3-butyl-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-butyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-butyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 3-butyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 3-butyl-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC1CCCO1)CC2=CC3=C(C=C(C=C3)C)NC2=O

Isomeric SMILES

CCCCNC(=S)N(C[C@H]1CCCO1)CC2=CC3=C(C=C(C=C3)C)NC2=O

InChI

InChI=1S/C21H29N3O2S/c1-3-4-9-22-21(27)24(14-18-6-5-10-26-18)13-17-12-16-8-7-15(2)11-19(16)23-20(17)25/h7-8,11-12,18H,3-6,9-10,13-14H2,1-2H3,(H,22,27)(H,23,25)/t18-/m1/s1