carboxy-dimethyl-[1-[4-[(3-methyl-2-methylimino-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: carboxy-dimethyl-[1-[4-[(3-methyl-2-methylimino-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-1-oxidanylidene-butan-2-yl]azanium Openeye Name: carboxy-dimethyl-[1-[4-[(3-methyl-2-methylimino-thiazol-4-yl)methyl]piperazine-1-carbonyl]propyl]ammonium CAS Name: carboxy-dimethyl-[1-[4-[(3-methyl-2-methylimino-4-thiazolyl)methyl]-1-piperazinyl]-1-oxobutan-2-yl]ammonium IUPAC Name: carboxy-dimethyl-[1-[4-[(3-methyl-2-methylimino-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-1-oxobutan-2-yl]azanium Traditional Name: carboxy-dimethyl-[1-[4-[(3-methyl-2-methylimino-4-thiazolin-4-yl)methyl]piperazine-1-carbonyl]propyl]ammonium Formula: C17H30N5O3S+ MolecularWeight: 384.5168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)CC2=CSC(=NC)N2C)[N+](C)(C)C(=O)O

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)CC2=CSC(=NC)N2C)[N+](C)(C)C(=O)O

InChI

InChI=1S/C17H29N5O3S/c1-6-14(22(4,5)17(24)25)15(23)21-9-7-20(8-10-21)11-13-12-26-16(18-2)19(13)3/h12,14H,6-11H2,1-5H3/p+1