azepan-1-yl-[2,2-bis(oxidanylidene)-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl]methanone

Systemtic Name: azepan-1-yl-[2,2-bis(oxidanylidene)-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl]methanone Openeye Name: (1-allyl-2,2-dioxo-4-phenyl-2$l^{6},1-benzothiazin-3-yl)-(azepan-1-yl)methanone CAS Name: 1-azepanyl-(2,2-dioxo-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl)methanone IUPAC Name: azepan-1-yl-(2,2-dioxo-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl)methanone Traditional Name: (1-allyl-2,2-diketo-4-phenyl-2$l^{6},1-benzothiazin-3-yl)-(azepan-1-yl)methanone Formula: C24H26N2O3S MolecularWeight: 422.53984

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2C(=C(S1(=O)=O)C(=O)N3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

C=CCN1C2=CC=CC=C2C(=C(S1(=O)=O)C(=O)N3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3S/c1-2-16-26-21-15-9-8-14-20(21)22(19-12-6-5-7-13-19)23(30(26,28)29)24(27)25-17-10-3-4-11-18-25/h2,5-9,12-15H,1,3-4,10-11,16-18H2