1-[(7-chloranyl-6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-phenethyl-thiourea

Systemtic Name: 1-[(7-chloranyl-6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-phenethyl-thiourea Openeye Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furylmethyl)-3-phenethyl-thiourea CAS Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-furanylmethyl)-3-phenethylthiourea IUPAC Name: 1-[(7-chloro-6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(furan-2-ylmethyl)-3-phenethylthiourea Traditional Name: 1-[(7-chloro-2-keto-6-methyl-1H-quinolin-3-yl)methyl]-1-(2-furfuryl)-3-phenethyl-thiourea Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CO3)C(=S)NCCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC=CO3)C(=S)NCCC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H24ClN3O2S/c1-17-12-19-13-20(24(30)28-23(19)14-22(17)26)15-29(16-21-8-5-11-31-21)25(32)27-10-9-18-6-3-2-4-7-18/h2-8,11-14H,9-10,15-16H2,1H3,(H,27,32)(H,28,30)