2-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-5-methoxy-benzamide

Systemtic Name: 2-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-5-methoxy-benzamide Openeye Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-5-methoxy-benzamide CAS Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-5-methoxybenzamide IUPAC Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-5-methoxybenzamide Traditional Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-5-methoxy-benzamide Formula: C23H29N5O2S MolecularWeight: 439.57366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N)C(=O)NCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

COC1=CC(=C(C=C1)N)C(=O)NCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C23H29N5O2S/c1-30-17-8-9-20(24)19(16-17)23(29)25-10-4-5-11-27-12-14-28(15-13-27)22-18-6-2-3-7-21(18)31-26-22/h2-3,6-9,16H,4-5,10-15,24H2,1H3,(H,25,29)