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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C(NC3=C(C=CC(=C3)[N+](C)(C)S(=O)O)N=C12)N4CCN(CC4)C

Isomeric SMILES

CC1=CSC2=C(NC3=C(C=CC(=C3)[N+](C)(C)S(=O)O)N=C12)N4CCN(CC4)C

InChI

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