1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ylpropyl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ylpropyl)-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholinopropyl)thiourea CAS Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-[3-(4-morpholinyl)propyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-benzyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-1-(3-morpholinopropyl)thiourea Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCN3CCOCC3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCN3CCOCC3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O3S/c1-32-23-9-8-21-16-22(25(31)28-24(21)17-23)19-30(11-5-10-29-12-14-33-15-13-29)26(34)27-18-20-6-3-2-4-7-20/h2-4,6-9,16-17H,5,10-15,18-19H2,1H3,(H,27,34)(H,28,31)