[3-[[3,7-bis(dimethylamino)phenothiazin-10-yl]carbonylcarbamoyl]phenyl]methyl-methoxy-carbamic acid

Systemtic Name: [3-[[3,7-bis(dimethylamino)phenothiazin-10-yl]carbonylcarbamoyl]phenyl]methyl-methoxy-carbamic acid Openeye Name: [3-[[3,7-bis(dimethylamino)phenothiazine-10-carbonyl]carbamoyl]phenyl]methyl-methoxy-carbamic acid CAS Name: [3-[[[[3,7-bis(dimethylamino)-10-phenothiazinyl]-oxomethyl]amino]-oxomethyl]phenyl]methyl-methoxycarbamic acid IUPAC Name: [3-[[3,7-bis(dimethylamino)phenothiazine-10-carbonyl]carbamoyl]phenyl]methyl-methoxycarbamic acid Traditional Name: [3-[[3,7-bis(dimethylamino)phenothiazine-10-carbonyl]carbamoyl]benzyl]-methoxy-carbamic acid Formula: C27H29N5O5S MolecularWeight: 535.61466

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)N(C)C)C(=O)NC(=O)C4=CC(=CC=C4)CN(C(=O)O)OC

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)N(C3=C(S2)C=C(C=C3)N(C)C)C(=O)NC(=O)C4=CC(=CC=C4)CN(C(=O)O)OC

InChI

InChI=1S/C27H29N5O5S/c1-29(2)19-9-11-21-23(14-19)38-24-15-20(30(3)4)10-12-22(24)32(21)26(34)28-25(33)18-8-6-7-17(13-18)16-31(37-5)27(35)36/h6-15H,16H2,1-5H3,(H,35,36)(H,28,33,34)