(4S)-4-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]-1-cyclopropyl-pyrrolidin-2-one

Systemtic Name: (4S)-4-[1-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]benzimidazol-2-yl]-1-cyclopropyl-pyrrolidin-2-one Openeye Name: (4S)-4-[1-[2-(azepan-1-yl)-2-oxo-ethyl]benzimidazol-2-yl]-1-cyclopropyl-pyrrolidin-2-one CAS Name: (4S)-4-[1-[2-(1-azepanyl)-2-oxoethyl]-2-benzimidazolyl]-1-cyclopropyl-2-pyrrolidinone IUPAC Name: (4S)-4-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]-1-cyclopropylpyrrolidin-2-one Traditional Name: (4S)-4-[1-[2-(azepan-1-yl)-2-keto-ethyl]benzimidazol-2-yl]-1-cyclopropyl-2-pyrrolidone Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2C4CC(=O)N(C4)C5CC5

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=CC=CC=C3N=C2[C@H]4CC(=O)N(C4)C5CC5

InChI

InChI=1S/C22H28N4O2/c27-20-13-16(14-25(20)17-9-10-17)22-23-18-7-3-4-8-19(18)26(22)15-21(28)24-11-5-1-2-6-12-24/h3-4,7-8,16-17H,1-2,5-6,9-15H2/t16-/m0/s1