1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-oxidanylpropyl)-3-phenethyl-thiourea

Systemtic Name: 1-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-oxidanylpropyl)-3-phenethyl-thiourea Openeye Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-phenethyl-thiourea CAS Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-phenethylthiourea IUPAC Name: 1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-hydroxypropyl)-3-phenethylthiourea Traditional Name: 1-(3-hydroxypropyl)-1-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCCO)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCCO)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O2S/c1-17-9-10-18(2)22-21(17)15-20(23(29)26-22)16-27(13-6-14-28)24(30)25-12-11-19-7-4-3-5-8-19/h3-5,7-10,15,28H,6,11-14,16H2,1-2H3,(H,25,30)(H,26,29)