ethyl N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate

Systemtic Name: ethyl N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate Openeye Name: ethyl N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate CAS Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate Traditional Name: N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamic acid ethyl ester Formula: C31H39N5O2S MolecularWeight: 545.73866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(SC(=N2)NC(=O)OCC)(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(SC(=N2)NC(=O)OCC)(C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C31H39N5O2S/c1-8-36(9-2)26-19-20-27-28(21-26)32-29(33-30(37)38-10-3)39-31(27,22-11-15-24(16-12-22)34(4)5)23-13-17-25(18-14-23)35(6)7/h11-21H,8-10H2,1-7H3,(H,32,33,37)