1-[(E)-[6-(3-methoxypropyl)-7-methyl-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]-1-methyl-thiourea

Systemtic Name: 1-[(E)-[6-(3-methoxypropyl)-7-methyl-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]-1-methyl-thiourea Openeye Name: 1-[(E)-[6-(3-methoxypropyl)-7-methyl-2-(3-methylimidazol-4-yl)-4-quinolyl]methyleneamino]-1-methyl-thiourea CAS Name: 1-[(E)-[6-(3-methoxypropyl)-7-methyl-2-(3-methyl-4-imidazolyl)-4-quinolinyl]methylideneamino]-1-methylthiourea IUPAC Name: 1-[(E)-[6-(3-methoxypropyl)-7-methyl-2-(3-methylimidazol-4-yl)quinolin-4-yl]methylideneamino]-1-methylthiourea Traditional Name: 1-[(E)-[6-(3-methoxypropyl)-7-methyl-2-(3-methylimidazol-4-yl)-4-quinolyl]methyleneamino]-1-methyl-thiourea Formula: C21H26N6OS MolecularWeight: 410.53574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=NC2=C1)C3=CN=CN3C)C=NN(C)C(=S)N)CCCOC

Isomeric SMILES

CC1=C(C=C2C(=CC(=NC2=C1)C3=CN=CN3C)/C=N/N(C)C(=S)N)CCCOC

InChI

InChI=1S/C21H26N6OS/c1-14-8-18-17(9-15(14)6-5-7-28-4)16(11-24-27(3)21(22)29)10-19(25-18)20-12-23-13-26(20)2/h8-13H,5-7H2,1-4H3,(H2,22,29)/b24-11+