3-azanylidene-N'-(4-ethanoylphenyl)-N-(4-ethoxyphenyl)-5-methyl-1,2-thiazole-2-carboximidamide

Systemtic Name: 3-azanylidene-N'-(4-ethanoylphenyl)-N-(4-ethoxyphenyl)-5-methyl-1,2-thiazole-2-carboximidamide Openeye Name: N'-(4-acetylphenyl)-N-(4-ethoxyphenyl)-3-imino-5-methyl-isothiazole-2-carboxamidine CAS Name: N'-(4-acetylphenyl)-N-(4-ethoxyphenyl)-3-imino-5-methyl-2-isothiazolecarboximidamide IUPAC Name: N'-(4-acetylphenyl)-N-(4-ethoxyphenyl)-3-imino-5-methyl-1,2-thiazole-2-carboximidamide Traditional Name: N'-(4-acetylphenyl)-3-imino-5-methyl-N-p-phenetyl-4-isothiazoline-2-carboxamidine Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C(=O)C)N3C(=N)C=C(S3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)C(=O)C)N3C(=N)C=C(S3)C

InChI

InChI=1S/C21H22N4O2S/c1-4-27-19-11-9-18(10-12-19)24-21(25-20(22)13-14(2)28-25)23-17-7-5-16(6-8-17)15(3)26/h5-13,22H,4H2,1-3H3,(H,23,24)