N-(2-diethylaminoethyl)-4-[(E)-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[(E)-(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Openeye Name: N-(2-diethylaminoethyl)-4-[(E)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide CAS Name: N-(2-diethylaminoethyl)-4-[(E)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide IUPAC Name: N-(2-diethylaminoethyl)-4-[(E)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Traditional Name: N-(2-diethylaminoethyl)-4-[(E)-(3-keto-4H-1,4-benzothiazin-2-ylidene)methyl]benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)C=C2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)/C=C/2\C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C22H25N3O2S/c1-3-25(4-2)14-13-23-21(26)17-11-9-16(10-12-17)15-20-22(27)24-18-7-5-6-8-19(18)28-20/h5-12,15H,3-4,13-14H2,1-2H3,(H,23,26)(H,24,27)/b20-15+