3-[3-[2-(2-methoxyethylamino)-1,3-thiazol-4-yl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-(2-methoxyethylamino)-1,3-thiazol-4-yl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-(2-methoxyethylamino)thiazol-4-yl]indol-1-yl]propanenitrile CAS Name: 3-[3-[2-(2-methoxyethylamino)-4-thiazolyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(2-methoxyethylamino)-1,3-thiazol-4-yl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-(2-methoxyethylamino)thiazol-4-yl]indol-1-yl]propionitrile Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=CS1)C2=CN(C3=CC=CC=C32)CCC#N

Isomeric SMILES

COCCNC1=NC(=CS1)C2=CN(C3=CC=CC=C32)CCC#N

InChI

InChI=1S/C17H18N4OS/c1-22-10-8-19-17-20-15(12-23-17)14-11-21(9-4-7-18)16-6-3-2-5-13(14)16/h2-3,5-6,11-12H,4,8-10H2,1H3,(H,19,20)