1-butyl-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea

Systemtic Name: 1-butyl-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea Openeye Name: 1-butyl-3-[4-(1-piperidylmethyl)phenyl]thiourea CAS Name: 1-butyl-3-[4-(1-piperidinylmethyl)phenyl]thiourea IUPAC Name: 1-butyl-3-[4-(piperidin-1-ylmethyl)phenyl]thiourea Traditional Name: 1-butyl-3-[4-(piperidinomethyl)phenyl]thiourea Formula: C17H27N3S MolecularWeight: 305.48138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=C(C=C1)CN2CCCCC2

Isomeric SMILES

CCCCNC(=S)NC1=CC=C(C=C1)CN2CCCCC2

InChI

InChI=1S/C17H27N3S/c1-2-3-11-18-17(21)19-16-9-7-15(8-10-16)14-20-12-5-4-6-13-20/h7-10H,2-6,11-14H2,1H3,(H2,18,19,21)