[4-(3,4-dipropoxyphenyl)-1,3-thiazol-2-yl]methylazanium

Systemtic Name: [4-(3,4-dipropoxyphenyl)-1,3-thiazol-2-yl]methylazanium Openeye Name: [4-(3,4-dipropoxyphenyl)thiazol-2-yl]methylammonium CAS Name: [4-(3,4-dipropoxyphenyl)-2-thiazolyl]methylammonium IUPAC Name: [4-(3,4-dipropoxyphenyl)-1,3-thiazol-2-yl]methylazanium Traditional Name: [4-(3,4-dipropoxyphenyl)thiazol-2-yl]methylammonium Formula: C16H23N2O2S+ MolecularWeight: 307.43102

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=CSC(=N2)C[NH3+])OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=CSC(=N2)C[NH3+])OCCC

InChI

InChI=1S/C16H22N2O2S/c1-3-7-19-14-6-5-12(9-15(14)20-8-4-2)13-11-21-16(10-17)18-13/h5-6,9,11H,3-4,7-8,10,17H2,1-2H3/p+1