3-[3-(diethylamino)propyl]-1-[(4-dimethylaminophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-[3-(diethylamino)propyl]-1-[(4-dimethylaminophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-[3-(diethylamino)propyl]-1-[(4-dimethylaminophenyl)methyl]-1-(3-pyridylmethyl)thiourea CAS Name: 3-[3-(diethylamino)propyl]-1-[(4-dimethylaminophenyl)methyl]-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-[3-(diethylamino)propyl]-1-[(4-dimethylaminophenyl)methyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-[3-(diethylamino)propyl]-1-[4-(dimethylamino)benzyl]-1-(3-pyridylmethyl)thiourea Formula: C23H35N5S MolecularWeight: 413.6225

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=S)N(CC1=CC=C(C=C1)N(C)C)CC2=CN=CC=C2

Isomeric SMILES

CCN(CC)CCCNC(=S)N(CC1=CC=C(C=C1)N(C)C)CC2=CN=CC=C2

InChI

InChI=1S/C23H35N5S/c1-5-27(6-2)16-8-15-25-23(29)28(19-21-9-7-14-24-17-21)18-20-10-12-22(13-11-20)26(3)4/h7,9-14,17H,5-6,8,15-16,18-19H2,1-4H3,(H,25,29)