1-[(4-dimethylaminophenyl)methyl]-3-heptyl-1-(3-imidazol-1-ylpropyl)thiourea

Systemtic Name: 1-[(4-dimethylaminophenyl)methyl]-3-heptyl-1-(3-imidazol-1-ylpropyl)thiourea Openeye Name: 1-[(4-dimethylaminophenyl)methyl]-3-heptyl-1-(3-imidazol-1-ylpropyl)thiourea CAS Name: 1-[(4-dimethylaminophenyl)methyl]-3-heptyl-1-[3-(1-imidazolyl)propyl]thiourea IUPAC Name: 1-[(4-dimethylaminophenyl)methyl]-3-heptyl-1-(3-imidazol-1-ylpropyl)thiourea Traditional Name: 1-[4-(dimethylamino)benzyl]-3-heptyl-1-(3-imidazol-1-ylpropyl)thiourea Formula: C23H37N5S MolecularWeight: 415.63838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)N(CCCN1C=CN=C1)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCCCCNC(=S)N(CCCN1C=CN=C1)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C23H37N5S/c1-4-5-6-7-8-14-25-23(29)28(17-9-16-27-18-15-24-20-27)19-21-10-12-22(13-11-21)26(2)3/h10-13,15,18,20H,4-9,14,16-17,19H2,1-3H3,(H,25,29)