1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(2-hydroxyethyl)thiourea

Systemtic Name: 1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(2-hydroxyethyl)thiourea Openeye Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(2-hydroxyethyl)thiourea CAS Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(2-hydroxyethyl)thiourea IUPAC Name: 1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-ethoxypropyl)-1-(2-hydroxyethyl)thiourea Traditional Name: 3-(3-ethoxypropyl)-1-(2-hydroxyethyl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]thiourea Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N(CCO)CC1=CC2=C(C(=C(C=C2)C)C)NC1=O

Isomeric SMILES

CCOCCCNC(=S)N(CCO)CC1=CC2=C(C(=C(C=C2)C)C)NC1=O

InChI

InChI=1S/C20H29N3O3S/c1-4-26-11-5-8-21-20(27)23(9-10-24)13-17-12-16-7-6-14(2)15(3)18(16)22-19(17)25/h6-7,12,24H,4-5,8-11,13H2,1-3H3,(H,21,27)(H,22,25)