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

Systemtic Name: 1-(furan-2-ylmethyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Openeye Name: 1-(2-furylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-(2-furanylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea IUPAC Name: 1-(furan-2-ylmethyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea Traditional Name: 1-(2-furfuryl)-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CO3)C(=S)NCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CO3)C(=S)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O3S/c1-30-21-10-9-19-14-20(24(29)27-23(19)15-21)16-28(17-22-8-5-13-31-22)25(32)26-12-11-18-6-3-2-4-7-18/h2-10,13-15H,11-12,16-17H2,1H3,(H,26,32)(H,27,29)