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1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile

1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name:1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]ethanoyl]pyrrolidine-2-carbonitrile
Openeye Name:1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]acetyl]pyrrolidine-2-carbonitrile
CAS Name:1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]-1-oxoethyl]-2-pyrrolidinecarbonitrile
IUPAC Name:1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]acetyl]pyrrolidine-2-carbonitrile
Traditional Name:1-[2-[2-(1,3-benzothiazol-2-ylamino)ethylamino]acetyl]pyrrolidine-2-carbonitrile
Formula: C16H19N5OS
MolecularWeight: 329.41996
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNCCNC2=NC3=CC=CC=C3S2)C#N


Isomeric SMILES

C1CC(N(C1)C(=O)CNCCNC2=NC3=CC=CC=C3S2)C#N


InChI

InChI=1S/C16H19N5OS/c17-10-12-4-3-9-21(12)15(22)11-18-7-8-19-16-20-13-5-1-2-6-14(13)23-16/h1-2,5-6,12,18H,3-4,7-9,11H2,(H,19,20)


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