3-cyclopropyl-1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-cyclopropyl-1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-cyclopropyl-1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)thiourea CAS Name: 3-cyclopropyl-1-[3-(1-imidazolyl)propyl]-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-cyclopropyl-1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-cyclopropyl-1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)thiourea Formula: C16H21N5S MolecularWeight: 315.43644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N(CCCN2C=CN=C2)CC3=CC=NC=C3

Isomeric SMILES

C1CC1NC(=S)N(CCCN2C=CN=C2)CC3=CC=NC=C3

InChI

InChI=1S/C16H21N5S/c22-16(19-15-2-3-15)21(12-14-4-6-17-7-5-14)10-1-9-20-11-8-18-13-20/h4-8,11,13,15H,1-3,9-10,12H2,(H,19,22)