S-[5-methyl-4-(phenylmethyl)-4H-imidazol-2-yl] 3-aminocarbonylpiperidine-1-carbothioate

Systemtic Name: S-[5-methyl-4-(phenylmethyl)-4H-imidazol-2-yl] 3-aminocarbonylpiperidine-1-carbothioate Openeye Name: S-(4-benzyl-5-methyl-4H-imidazol-2-yl) 3-carbamoylpiperidine-1-carbothioate CAS Name: 3-carbamoyl-1-piperidinecarbothioic acid S-[5-methyl-4-(phenylmethyl)-4H-imidazol-2-yl] ester IUPAC Name: S-(4-benzyl-5-methyl-4H-imidazol-2-yl) 3-carbamoylpiperidine-1-carbothioate Traditional Name: 3-carbamoylpiperidine-1-carbothioic acid S-(4-benzyl-5-methyl-4H-imidazol-2-yl) ester Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC1CC2=CC=CC=C2)SC(=O)N3CCCC(C3)C(=O)N

Isomeric SMILES

CC1=NC(=NC1CC2=CC=CC=C2)SC(=O)N3CCCC(C3)C(=O)N

InChI

InChI=1S/C18H22N4O2S/c1-12-15(10-13-6-3-2-4-7-13)21-17(20-12)25-18(24)22-9-5-8-14(11-22)16(19)23/h2-4,6-7,14-15H,5,8-11H2,1H3,(H2,19,23)