diethyl-[(4S)-4-[2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoylamino]pentyl]azanium

Systemtic Name: diethyl-[(4S)-4-[2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoylamino]pentyl]azanium Openeye Name: diethyl-[(4S)-4-[[2-(3-oxo-1,4-benzothiazin-4-yl)acetyl]amino]pentyl]ammonium CAS Name: diethyl-[(4S)-4-[[1-oxo-2-(3-oxo-1,4-benzothiazin-4-yl)ethyl]amino]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[[2-(3-oxo-1,4-benzothiazin-4-yl)acetyl]amino]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[[2-(3-keto-1,4-benzothiazin-4-yl)acetyl]amino]pentyl]ammonium Formula: C19H30N3O2S+ MolecularWeight: 364.5254

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)CN1C(=O)CSC2=CC=CC=C21

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)CN1C(=O)CSC2=CC=CC=C21

InChI

InChI=1S/C19H29N3O2S/c1-4-21(5-2)12-8-9-15(3)20-18(23)13-22-16-10-6-7-11-17(16)25-14-19(22)24/h6-7,10-11,15H,4-5,8-9,12-14H2,1-3H3,(H,20,23)/p+1/t15-/m0/s1