1-[2-(acridin-10-ium-9-ylamino)ethyl]-1,3-dimethyl-thiourea nitrate

Systemtic Name: 1-[2-(acridin-10-ium-9-ylamino)ethyl]-1,3-dimethyl-thiourea nitrate Openeye Name: 1-[2-(acridin-10-ium-9-ylamino)ethyl]-1,3-dimethyl-thiourea nitrate CAS Name: 1-[2-(9-acridin-10-iumylamino)ethyl]-1,3-dimethylthiourea nitrate IUPAC Name: 1-[2-(acridin-10-ium-9-ylamino)ethyl]-1,3-dimethylthiourea nitrate Traditional Name: 1-[2-(acridin-10-ium-9-ylamino)ethyl]-1,3-dimethyl-thiourea nitrate Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N(C)CCNC1=C2C=CC=CC2=[NH+]C3=CC=CC=C31.[N+](=O)([O-])[O-]

Isomeric SMILES

CNC(=S)N(C)CCNC1=C2C=CC=CC2=[NH+]C3=CC=CC=C31.[N+](=O)([O-])[O-]

InChI

InChI=1S/C18H20N4S.NO3/c1-19-18(23)22(2)12-11-20-17-13-7-3-5-9-15(13)21-16-10-6-4-8-14(16)17;2-1(3)4/h3-10H,11-12H2,1-2H3,(H,19,23)(H,20,21);/q;-1/p+1