[5-(1-methylimidazol-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-pentan-2-yl]carbamoyl hydrogen carbonate

Systemtic Name: [5-(1-methylimidazol-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-pentan-2-yl]carbamoyl hydrogen carbonate Openeye Name: [4-(1-methylimidazol-2-yl)sulfanyl-1-(4-methylpiperidine-1-carbonyl)butyl]carbamoyl hydrogen carbonate CAS Name: carbonic acid [[[5-[(1-methyl-2-imidazolyl)thio]-1-(4-methyl-1-piperidinyl)-1-oxopentan-2-yl]amino]-oxomethyl] ester IUPAC Name: [5-(1-methylimidazol-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)-1-oxopentan-2-yl]carbamoyl hydrogen carbonate Traditional Name: carbonic acid [4-[(1-methylimidazol-2-yl)thio]-1-(4-methylpiperidine-1-carbonyl)butyl]carbamoyl ester Formula: C17H26N4O5S MolecularWeight: 398.47714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CCCSC2=NC=CN2C)NC(=O)OC(=O)O

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CCCSC2=NC=CN2C)NC(=O)OC(=O)O

InChI

InChI=1S/C17H26N4O5S/c1-12-5-8-21(9-6-12)14(22)13(19-16(23)26-17(24)25)4-3-11-27-15-18-7-10-20(15)2/h7,10,12-13H,3-6,8-9,11H2,1-2H3,(H,19,23)(H,24,25)