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

Systemtic Name: 2-methylpropyl N-[7-(diethylamino)-4,4-bis(4-dimethylaminophenyl)-3,1-benzothiazin-2-yl]carbamate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 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 isobutyl ester Formula: C33H43N5O2S MolecularWeight: 573.79182

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H43N5O2S/c1-9-38(10-2)28-19-20-29-30(21-28)34-31(35-32(39)40-22-23(3)4)41-33(29,24-11-15-26(16-12-24)36(5)6)25-13-17-27(18-14-25)37(7)8/h11-21,23H,9-10,22H2,1-8H3,(H,34,35,39)