2-methyl-4-[2-[3-[methyl(sulfinato)amino]pyrrolidin-1-yl]ethylcarbamoylamino]quinoline

Systemtic Name: 2-methyl-4-[2-[3-[methyl(sulfinato)amino]pyrrolidin-1-yl]ethylcarbamoylamino]quinoline Openeye Name: 2-methyl-4-[2-[3-[methyl(sulfinato)amino]pyrrolidin-1-yl]ethylcarbamoylamino]quinoline CAS Name: 2-methyl-4-[[[2-[3-[methyl(sulfinato)amino]-1-pyrrolidinyl]ethylamino]-oxomethyl]amino]quinoline IUPAC Name: 2-methyl-4-[2-[3-[methyl(sulfinato)amino]pyrrolidin-1-yl]ethylcarbamoylamino]quinoline Traditional Name: 2-methyl-4-[2-[3-[methyl(sulfinato)amino]pyrrolidino]ethylcarbamoylamino]quinoline Formula: C18H24N5O3S- MolecularWeight: 390.47986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCC(C3)N(C)S(=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)NCCN3CCC(C3)N(C)S(=O)[O-]

InChI

InChI=1S/C18H25N5O3S/c1-13-11-17(15-5-3-4-6-16(15)20-13)21-18(24)19-8-10-23-9-7-14(12-23)22(2)27(25)26/h3-6,11,14H,7-10,12H2,1-2H3,(H,25,26)(H2,19,20,21,24)/p-1