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

Systemtic Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-cyclopentyl-thiourea Openeye Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-cyclopentyl-thiourea CAS Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-3-cyclopentylthiourea IUPAC Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-cyclopentylthiourea Traditional Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-3-cyclopentyl-thiourea Formula: C25H31N5S2 MolecularWeight: 465.67714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NC2=CC=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

C1CCC(C1)NC(=S)NC2=CC=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C25H31N5S2/c31-25(26-20-5-1-2-6-20)27-21-11-9-19(10-12-21)13-14-29-15-17-30(18-16-29)24-22-7-3-4-8-23(22)32-28-24/h3-4,7-12,20H,1-2,5-6,13-18H2,(H2,26,27,31)