1-[3-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]propyl]-3-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 1-[3-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]propyl]-3-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[3-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]propyl]-3-(3-morpholinopropyl)thiourea CAS Name: 1-[3-[(3-cyano-6,8-dimethyl-2-quinolinyl)amino]propyl]-3-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[3-[(3-cyano-6,8-dimethylquinolin-2-yl)amino]propyl]-3-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-[3-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]propyl]-3-(3-morpholinopropyl)thiourea Formula: C23H32N6OS MolecularWeight: 440.60478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCCNC(=S)NCCCN3CCOCC3)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCCNC(=S)NCCCN3CCOCC3)C#N)C

InChI

InChI=1S/C23H32N6OS/c1-17-13-18(2)21-19(14-17)15-20(16-24)22(28-21)25-5-3-6-26-23(31)27-7-4-8-29-9-11-30-12-10-29/h13-15H,3-12H2,1-2H3,(H,25,28)(H2,26,27,31)