3-butyl-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2S)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 3-butyl-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-[[(2S)-oxolan-2-yl]methyl]thiourea Openeye Name: 3-butyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2S)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 3-butyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2S)-2-oxolanyl]methyl]thiourea IUPAC Name: 3-butyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2S)-oxolan-2-yl]methyl]thiourea Traditional Name: 3-butyl-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-1-[[(2S)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3S/c1-3-4-9-22-21(28)24(14-18-6-5-10-27-18)13-16-11-15-12-17(26-2)7-8-19(15)23-20(16)25/h7-8,11-12,18H,3-6,9-10,13-14H2,1-2H3,(H,22,28)(H,23,25)/t18-/m0/s1