(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[[5-(2-methylthiazol-4-yl)-2-thienyl]methyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[[5-(2-methyl-4-thiazolyl)-2-thiophenyl]methyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]azanium Traditional Name: (2-keto-7,8-dimethyl-chromen-4-yl)methyl-[[5-(2-methylthiazol-4-yl)-2-thienyl]methyl]ammonium Formula: C21H21N2O2S2+ MolecularWeight: 397.53364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC3=CC=C(S3)C4=CSC(=N4)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH2+]CC3=CC=C(S3)C4=CSC(=N4)C)C

InChI

InChI=1S/C21H20N2O2S2/c1-12-4-6-17-15(8-20(24)25-21(17)13(12)2)9-22-10-16-5-7-19(27-16)18-11-26-14(3)23-18/h4-8,11,22H,9-10H2,1-3H3/p+1