1-[1-[4-(aminomethyl)piperidin-1-yl]sulfonylcyclohexa-2,4-dien-1-yl]-3-(3-thiophen-2-ylpropyl)urea

Systemtic Name: 1-[1-[4-(aminomethyl)piperidin-1-yl]sulfonylcyclohexa-2,4-dien-1-yl]-3-(3-thiophen-2-ylpropyl)urea Openeye Name: 1-[1-[[4-(aminomethyl)-1-piperidyl]sulfonyl]cyclohexa-2,4-dien-1-yl]-3-[3-(2-thienyl)propyl]urea CAS Name: 1-[1-[[4-(aminomethyl)-1-piperidinyl]sulfonyl]-1-cyclohexa-2,4-dienyl]-3-(3-thiophen-2-ylpropyl)urea IUPAC Name: 1-[1-[4-(aminomethyl)piperidin-1-yl]sulfonylcyclohexa-2,4-dien-1-yl]-3-(3-thiophen-2-ylpropyl)urea Traditional Name: 1-[1-[4-(aminomethyl)piperidino]sulfonylcyclohexa-2,4-dien-1-yl]-3-[3-(2-thienyl)propyl]urea Formula: C20H30N4O3S2 MolecularWeight: 438.6072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)S(=O)(=O)C2(CC=CC=C2)NC(=O)NCCCC3=CC=CS3

Isomeric SMILES

C1CN(CCC1CN)S(=O)(=O)C2(CC=CC=C2)NC(=O)NCCCC3=CC=CS3

InChI

InChI=1S/C20H30N4O3S2/c21-16-17-8-13-24(14-9-17)29(26,27)20(10-2-1-3-11-20)23-19(25)22-12-4-6-18-7-5-15-28-18/h1-3,5,7,10,15,17H,4,6,8-9,11-14,16,21H2,(H2,22,23,25)