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

Systemtic Name: 3-[3-[2-(cyclohexylamino)-1,3-thiazol-4-yl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-(cyclohexylamino)thiazol-4-yl]indol-1-yl]propanenitrile CAS Name: 3-[3-[2-(cyclohexylamino)-4-thiazolyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(cyclohexylamino)-1,3-thiazol-4-yl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-(cyclohexylamino)thiazol-4-yl]indol-1-yl]propionitrile Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=CS2)C3=CN(C4=CC=CC=C43)CCC#N

Isomeric SMILES

C1CCC(CC1)NC2=NC(=CS2)C3=CN(C4=CC=CC=C43)CCC#N

InChI

InChI=1S/C20H22N4S/c21-11-6-12-24-13-17(16-9-4-5-10-19(16)24)18-14-25-20(23-18)22-15-7-2-1-3-8-15/h4-5,9-10,13-15H,1-3,6-8,12H2,(H,22,23)