3-(2-methoxyphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-oxidanylpropyl)thiourea

Systemtic Name: 3-(2-methoxyphenyl)-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-oxidanylpropyl)thiourea Openeye Name: 1-(3-hydroxypropyl)-3-(2-methoxyphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-(3-hydroxypropyl)-3-(2-methoxyphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-(3-hydroxypropyl)-3-(2-methoxyphenyl)-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-(3-hydroxypropyl)-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(2-methoxyphenyl)thiourea Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)C(=S)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCCO)C(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H25N3O3S/c1-15-8-9-18-16(12-15)13-17(21(27)23-18)14-25(10-5-11-26)22(29)24-19-6-3-4-7-20(19)28-2/h3-4,6-9,12-13,26H,5,10-11,14H2,1-2H3,(H,23,27)(H,24,29)