1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-butyl-thiourea

Systemtic Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-butyl-thiourea Openeye Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-butyl-thiourea CAS Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-3-butylthiourea IUPAC Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-butylthiourea Traditional Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-3-butyl-thiourea Formula: C24H31N5S2 MolecularWeight: 453.66644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCCCNC(=S)NC1=CC=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C24H31N5S2/c1-2-3-12-25-24(30)26-20-8-6-7-19(18-20)11-13-28-14-16-29(17-15-28)23-21-9-4-5-10-22(21)31-27-23/h4-10,18H,2-3,11-17H2,1H3,(H2,25,26,30)