3-[3-(diethylamino)propyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-[3-(diethylamino)propyl]-1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[3-(diethylamino)propyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-[3-(diethylamino)propyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[3-(diethylamino)propyl]-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-benzyl-3-[3-(diethylamino)propyl]-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=S)N(CC1=CC=CC=C1)CC2=CC3=C(C=C(C=C3)C)NC2=O

Isomeric SMILES

CCN(CC)CCCNC(=S)N(CC1=CC=CC=C1)CC2=CC3=C(C=C(C=C3)C)NC2=O

InChI

InChI=1S/C26H34N4OS/c1-4-29(5-2)15-9-14-27-26(32)30(18-21-10-7-6-8-11-21)19-23-17-22-13-12-20(3)16-24(22)28-25(23)31/h6-8,10-13,16-17H,4-5,9,14-15,18-19H2,1-3H3,(H,27,32)(H,28,31)