1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-prop-2-enyl-urea

Systemtic Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-prop-2-enyl-urea Openeye Name: 1-allyl-3-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]urea CAS Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-3-prop-2-enylurea IUPAC Name: 1-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-prop-2-enylurea Traditional Name: 1-allyl-3-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]urea Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C23H27N5OS/c1-2-12-24-23(29)25-19-9-7-18(8-10-19)11-13-27-14-16-28(17-15-27)22-20-5-3-4-6-21(20)30-26-22/h2-10H,1,11-17H2,(H2,24,25,29)