1-(3-ethoxypropyl)-3-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]thiourea

Systemtic Name: 1-(3-ethoxypropyl)-3-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]thiourea Openeye Name: 1-(3-ethoxypropyl)-3-[2-(4-ethylpiperazin-1-yl)-4-methyl-6-quinolyl]thiourea CAS Name: 1-(3-ethoxypropyl)-3-[2-(4-ethyl-1-piperazinyl)-4-methyl-6-quinolinyl]thiourea IUPAC Name: 1-(3-ethoxypropyl)-3-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]thiourea Traditional Name: 1-(3-ethoxypropyl)-3-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]thiourea Formula: C22H33N5OS MolecularWeight: 415.59532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=S)NCCCOCC)C(=C2)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=S)NCCCOCC)C(=C2)C

InChI

InChI=1S/C22H33N5OS/c1-4-26-10-12-27(13-11-26)21-15-17(3)19-16-18(7-8-20(19)25-21)24-22(29)23-9-6-14-28-5-2/h7-8,15-16H,4-6,9-14H2,1-3H3,(H2,23,24,29)