3-[(3S)-5-(benzimidazol-2-ylidene)pyrazolidin-3-yl]-2-chloranyl-7-methyl-quinoline

Systemtic Name: 3-[(3S)-5-(benzimidazol-2-ylidene)pyrazolidin-3-yl]-2-chloranyl-7-methyl-quinoline Openeye Name: 3-[(3S)-5-(benzimidazol-2-ylidene)pyrazolidin-3-yl]-2-chloro-7-methyl-quinoline CAS Name: 3-[(3S)-5-(2-benzimidazolylidene)-3-pyrazolidinyl]-2-chloro-7-methylquinoline IUPAC Name: 3-[(3S)-5-(benzimidazol-2-ylidene)pyrazolidin-3-yl]-2-chloro-7-methylquinoline Traditional Name: 3-[(3S)-5-(benzimidazol-2-ylidene)pyrazolidin-3-yl]-2-chloro-7-methyl-quinoline Formula: C20H16ClN5 MolecularWeight: 361.82754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C3CC(=C4N=C5C=CC=CC5=N4)NN3)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)[C@@H]3CC(=C4N=C5C=CC=CC5=N4)NN3)Cl

InChI

InChI=1S/C20H16ClN5/c1-11-6-7-12-9-13(19(21)22-16(12)8-11)17-10-18(26-25-17)20-23-14-4-2-3-5-15(14)24-20/h2-9,17,25-26H,10H2,1H3/t17-/m0/s1