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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1(C#N)NCCNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)N1CCCC1(C#N)NCCNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H19N5OS/c1-12(22)21-10-4-7-16(21,11-17)19-9-8-18-15-20-13-5-2-3-6-14(13)23-15/h2-3,5-6,19H,4,7-10H2,1H3,(H,18,20)