(2R)-2-methyl-2,4-dithiophen-2-yl-1,3-dihydro-1,5-benzodiazepin-5-ium

Systemtic Name: (2R)-2-methyl-2,4-dithiophen-2-yl-1,3-dihydro-1,5-benzodiazepin-5-ium Openeye Name: (2R)-2-methyl-2,4-bis(2-thienyl)-1,3-dihydro-1,5-benzodiazepin-5-ium CAS Name: (2R)-2-methyl-2,4-dithiophen-2-yl-1,3-dihydro-1,5-benzodiazepin-5-ium IUPAC Name: (2R)-2-methyl-2,4-dithiophen-2-yl-1,3-dihydro-1,5-benzodiazepin-5-ium Traditional Name: (2R)-2-methyl-2,4-bis(2-thienyl)-1,3-dihydro-1,5-benzodiazepin-5-ium Formula: C18H17N2S2+ MolecularWeight: 325.47098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=[NH+]C2=CC=CC=C2N1)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

C[C@@]1(CC(=[NH+]C2=CC=CC=C2N1)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C18H16N2S2/c1-18(17-9-5-11-22-17)12-15(16-8-4-10-21-16)19-13-6-2-3-7-14(13)20-18/h2-11,20H,12H2,1H3/p+1/t18-/m1/s1