ethyl N-[6-chloranyl-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate

Systemtic Name: ethyl N-[6-chloranyl-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate Openeye Name: ethyl N-[6-chloro-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate CAS Name: N-[6-chloro-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-chloro-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate Traditional Name: N-[6-chloro-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamic acid ethyl ester Formula: C27H29ClN4O2S MolecularWeight: 509.06276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(C=C(C=C2)Cl)C(S1)(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCOC(=O)NC1=NC2=C(C=C(C=C2)Cl)C(S1)(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H29ClN4O2S/c1-6-34-26(33)30-25-29-24-16-11-20(28)17-23(24)27(35-25,18-7-12-21(13-8-18)31(2)3)19-9-14-22(15-10-19)32(4)5/h7-17H,6H2,1-5H3,(H,29,30,33)