dimethyl-[2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[3,2-b][1,5]benzodiazepin-7-yl]-sulfino-azanium

Systemtic Name: dimethyl-[2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[3,2-b][1,5]benzodiazepin-7-yl]-sulfino-azanium Openeye Name: dimethyl-[2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[3,2-b][1,5]benzodiazepin-7-yl]-sulfino-ammonium CAS Name: dimethyl-[2-methyl-4-(4-methyl-1-piperazinyl)-10H-thieno[3,2-b][1,5]benzodiazepin-7-yl]-sulfinoammonium IUPAC Name: dimethyl-[2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[3,2-b][1,5]benzodiazepin-7-yl]-sulfinoazanium Traditional Name: dimethyl-[2-methyl-4-(4-methylpiperazino)-10H-thieno[3,2-b][1,5]benzodiazepin-7-yl]-sulfino-ammonium Formula: C19H26N5O2S2+ MolecularWeight: 420.57204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)C(=NC3=C(N2)C=CC(=C3)[N+](C)(C)S(=O)O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC2=C(S1)C(=NC3=C(N2)C=CC(=C3)[N+](C)(C)S(=O)O)N4CCN(CC4)C

InChI

InChI=1S/C19H25N5O2S2/c1-13-11-17-18(27-13)19(23-9-7-22(2)8-10-23)21-16-12-14(5-6-15(16)20-17)24(3,4)28(25)26/h5-6,11-12,20H,7-10H2,1-4H3/p+1